NMR Compound Spectrum Catalog

Experimental ¹H / ¹³C pages for common laboratory compounds. Filter by letter or carbon count, then open a compound for peak tables and stick spectra. Also try ¹H prediction and ¹³C prediction.

Browse All 2593

A–ZA 93 B 92 C 104 D 199 E 103 F 17 G 32 H 53 I 83 J 1 K 3 L 15 M 143 N 101 O 39 P 149 Q 4 R 5 S 37 T 133 U 41 V 30WX 2YZ 1 # 1113

CarbonsC1–C4 539 C5–C8 1285 C9–C12 768 C13–C18 1C19+

Showing 1441–1520 of 2,593 · all compounds · page 19/33

Name	CAS	Formula	Slug
Dichloroisoproterenol	59-61-0	C11H15Cl2NO	`dichloroisoproterenol`
Dichloromethane	75-09-2	CH2Cl2	`dichloromethane`
Dichloromethyloctylsilane	14799-93-0	C9H20Cl2Si	`dichloromethyloctylsilane`
dichlorvos	62-73-7	C4H7Cl2O4P	`dichlorvos`
Diepoxybutane	1464-53-5	C4H6O2	`diepoxybutane`
Diethanolamine	111-42-2	C4H11NO2	`diethanolamine`
Diethoxy(methyl)silane	2031-62-1	C5H14O2Si	`diethoxymethylsilane`
Diethyl (chloromethyl)phosphonate	3167-63-3	C5H12ClO3P	`diethyl-chloromethylphosphonate`
Diethyl 3-hydroxyglutarate	32328-03-3	C9H16O5	`diethyl-3-hydroxyglutarate`
Diethyl acetylenedicarboxylate	762-21-0	C8H10O4	`diethyl-acetylenedicarboxylate`
Diethyl allylmalonate	2049-80-1	C10H16O4	`diethyl-allylmalonate`
Diethyl bis(hydroxymethyl)malonate	20605-01-0	C9H16O6	`diethyl-bishydroxymethylmalonate`
Diethyl bromomethylmalonate	29263-94-3	C8H13BrO4	`diethyl-bromomethylmalonate`
Diethyl Carbonate	105-58-8	C5H10O3	`diethyl-carbonate`
Diethyl Chlorophosphate	814-49-3	C4H10ClO3P	`diethyl-chlorophosphate`
Diethyl Ether	60-29-7	C4H10O	`diethyl-ether`
Diethyl hexafluoroglutarate	424-40-8	C9H10F6O4	`diethyl-hexafluoroglutarate`
Diethyl isopropylidenemalonate	6802-75-1	C10H16O4	`diethyl-isopropylidenemalonate`
Diethyl Malate	7554-12-3	C8H14O5	`diethyl-malate`
Diethyl mesoxalate	609-09-6	C7H10O5	`diethyl-mesoxalate`
Diethyl Methylmalonate	609-08-5	C8H14O4	`diethyl-methylmalonate`
Diethyl phenylphosphonate	1754-49-0	C10H15O3P	`diethyl-phenylphosphonate`
Diethyl phosphorous acid	123-22-8	C4H11O3P	`diethyl-phosphorous-acid`
Diethyl Propylmalonate	2163-48-6	C10H18O4	`diethyl-propylmalonate`
Diethyl Selenide	627-53-2	C4H10Se	`diethyl-selenide`
Diethyl squarate	5231-87-8	C8H10O4	`diethyl-squarate`
Diethyl sulfate	64-67-5	C4H10O4S	`diethyl-sulfate`
Diethyl sulfide	352-93-2	C4H10S	`diethyl-sulfide`
Diethyl sulfite	623-81-4	C4H10O3S	`diethyl-sulfite`
Diethylamine	109-89-7	C4H11N	`diethylamine`
Diethylaminotrimethylsilane	996-50-9	C7H19NSi	`diethylaminotrimethylsilane`
Diethylaniline	91-66-7	C10H15N	`diethylaniline`
Diethylcarbamoyl Chloride	88-10-8	C5H10ClNO	`diethylcarbamoyl-chloride`
Diethylene Glycol Diethyl Ether	112-36-7	C8H18O3	`diethylene-glycol-diethyl-ether`
Diethylene glycol monohexyl ether	112-59-4	C10H22O3	`diethylene-glycol-monohexyl-ether`
Diethylenetriamine	111-40-0	C4H13N3	`diethylenetriamine`
Diethylhydroxylamine	3710-84-7	C4H11NO	`diethylhydroxylamine`
Diethylmercury	627-44-1	C4H10Hg	`diethylmercury`
Diethylmethylamine	616-39-7	C5H13N	`diethylmethylamine`
Diethylphenylphosphine	1605-53-4	C10H15P	`diethylphenylphosphine`
Difluoroacetic Acid	381-73-7	C2H2F2O2	`difluoroacetic-acid`
Difluorotrichloroethane	354-21-2	C2HCl3F2	`difluorotrichloroethane`
Diglycolic acid	110-99-6	C4H6O5	`diglycolic-acid`
Diglyme	111-96-6	C6H14O3	`diglyme`
Dihydrocaffeic acid	1078-61-1	C9H10O4	`dihydrocaffeic-acid`
Dihydroconiferyl alcohol	2305-13-7	C10H14O3	`dihydroconiferyl-alcohol`
dihydrocoumarin	119-84-6	C9H8O2	`dihydrocoumarin`
Dihydroorotic acid	155-54-4	C5H6N2O4	`dihydroorotic-acid`
dihydrouracil	504-07-4	C4H6N2O2	`dihydrouracil`
Dihydroxyacetone	96-26-4	C3H6O3	`dihydroxyacetone`
Diisoamylamine	544-00-3	C10H23N	`diisoamylamine`
Diisobutyl Ketone	108-83-8	C9H18O	`diisobutyl-ketone`
Diisobutylamine	110-96-3	C8H19N	`diisobutylamine`
Diisobutylene	107-39-1	C8H16	`diisobutylene`
Diisopentyl ether	544-01-4	C10H22O	`diisopentyl-ether`
Diisopropanolamine	110-97-4	C6H15NO2	`diisopropanolamine`
Diisopropyl disulfide	4253-89-8	C6H14S2	`diisopropyl-disulfide`
Diisopropyl Ether	108-20-3	C6H14O	`diisopropyl-ether`
Diisopropyl malonate	13195-64-7	C9H16O4	`diisopropyl-malonate`
Diisopropyl Methyl Carbinol	123-44-4	C8H18O	`diisopropyl-methyl-carbinol`
Diisopropyl succinate	924-88-9	C10H18O4	`diisopropyl-succinate`
Diisopropylmethylcarbinol	3054-92-0	C8H18O	`diisopropylmethylcarbinol`
Diisopropylthiourea	2986-17-6	C7H16N2S	`diisopropylthiourea`
Dimercaprol	59-52-9	C3H8OS2	`dimercaprol`
dimethadione	695-53-4	C5H7NO3	`dimethadione`
dimethoate	60-51-5	C5H12NO3PS2	`dimethoate`
Dimethoxydimethylsilane	1112-39-6	C4H12O2Si	`dimethoxydimethylsilane`
Dimethoxymethane	109-87-5	C3H8O2	`dimethoxymethane`
Dimethoxymethylphenylsilane	3027-21-2	C9H14O2Si	`dimethoxymethylphenylsilane`
Dimethyl (2-oxoheptyl)phosphonate	36969-89-8	C9H19O4P	`dimethyl-2-oxoheptylphosphonate`
Dimethyl (2-oxopropyl)phosphonate	4202-14-6	C5H11O4P	`dimethyl-2-oxopropylphosphonate`
Dimethyl 4-hydroxyphthalate	22479-95-4	C10H10O5	`dimethyl-4-hydroxyphthalate`
Dimethyl 5-aminoisophthalate	99-27-4	C10H11NO4	`dimethyl-5-aminoisophthalate`
Dimethyl acetal	534-15-6	C4H10O2	`dimethyl-acetal`
Dimethyl acetylsuccinate	10420-33-4	C8H12O5	`dimethyl-acetylsuccinate`
Dimethyl malate	1587-15-1	C6H10O5	`dimethyl-malate`
Dimethyl malonate	108-59-8	C5H8O4	`dimethyl-malonate`
Dimethyl Methylphosphonate	756-79-6	C3H9O3P	`dimethyl-methylphosphonate`
Dimethyl oxalate	553-90-2	C4H6O4	`dimethyl-oxalate`
dimethyl sulfide	75-18-3	C2H6S	`dimethyl-sulfide`

References & data sources

NMRShiftDB2 — open experimental NMR chemical shift database.
Steinbeck, C.; Kuhn, S. NMRShiftDB — nmrshiftdb.nmr.uni-koeln.de
Gottlieb, H. E.; Kotlyar, V.; Nudelman, A. NMR Chemical Shifts of Common Laboratory Solvents as Trace Impurities. J. Org. Chem. 1997, 62, 7512–7515.
Fulmer, G. R. et al. NMR Chemical Shifts of Trace Impurities. Organometallics 2010, 29, 2176–2179.
PubChem — compound identifiers and structure depictions (NIH/NCBI).
Related tools: nmrdb.org (community NMR prediction reference).