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 81–160 of 199 · letter D · page 2/3

Name	CAS	Formula	Slug
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`
Dimethyl sulfite	616-42-2	C2H6O3S	`dimethyl-sulfite`
Dimethyl sulfone	67-71-0	C2H6O2S	`dimethyl-sulfone`
Dimethyl Sulfoxide	67-68-5	C2H6OS	`dimethyl-sulfoxide`
Dimethyl Terephthalate	120-61-6	C10H10O4	`dimethyl-terephthalate`
Dimethyl thiodipropionate	4131-74-2	C8H14O4S	`dimethyl-thiodipropionate`
Dimethyl(2-(methylamino)ethyl)amine	142-25-6	C5H14N2	`dimethyl2-methylaminoethylamine`
dimethylacetoacetamide	2044-64-6	C6H11NO2	`dimethylacetoacetamide`
Dimethyladipate	627-93-0	C8H14O4	`dimethyladipate`
Dimethylamid kyseliny akrylove	2680-03-7	C5H9NO	`dimethylamid-kyseliny-akrylove`
Dimethylamide of propionic acid	758-96-3	C5H11NO	`dimethylamide-of-propionic-acid`
Dimethylaminoacetonitrile	926-64-7	C4H8N2	`dimethylaminoacetonitrile`
Dimethylaniline	121-69-7	C8H11N	`dimethylaniline`
Dimethyldichloromethane	594-20-7	C3H6Cl2	`dimethyldichloromethane`
Dimethyldithiocarbamic Acid Allyl Ester	20821-66-3	C6H11NS2	`dimethyldithiocarbamic-acid-allyl-ester`
Dimethylethylene glycol	513-85-9	C4H10O2	`dimethylethylene-glycol`
dimethylglycine	1118-68-9	C4H9NO2	`dimethylglycine`
Dimethylhydantoin	77-71-4	C5H8N2O2	`dimethylhydantoin`
Dimethylketene dimer	3173-79-3	C8H12O2	`dimethylketene-dimer`
Dimethylmalonic Acid	595-46-0	C5H8O4	`dimethylmalonic-acid`
dimethylolbutyric acid	10097-02-6	C6H12O4	`dimethylolbutyric-acid`
Dimethylolpropionic acid	4767-03-7	C5H10O4	`dimethylolpropionic-acid`
Dimethylphosphinic acid	3283-12-3	C2H7O2P	`dimethylphosphinic-acid`
dimethylsilyl chloride	1066-35-9	C2H7ClSi	`dimethylsilyl-chloride`
Dimethyltin dichloride	753-73-1	C2H6Cl2Sn	`dimethyltin-dichloride`
Dioxabenzofos	3811-49-2	C8H9O3PS	`dioxabenzofos`
Dioxolane	646-06-0	C3H6O2	`dioxolane`
Dipentaerythritol	126-58-9	C10H22O7	`dipentaerythritol`
Dipentyl disulphide	112-51-6	C10H22S2	`dipentyl-disulphide`
Dipentylamine	2050-92-2	C10H23N	`dipentylamine`
Diphosphoglyceric acid	138-81-8	C3H8O10P2	`diphosphoglyceric-acid`
Dipicolinic acid	499-83-2	C7H5NO4	`dipicolinic-acid`
Dipropylmalonic acid	1636-27-7	C9H16O4	`dipropylmalonic-acid`
disulfiram	97-77-8	C10H20N2S4	`disulfiram`
disulfoton	298-04-4	C8H19O2PS3	`disulfoton`
Dithienyl	492-97-7	C8H6S2	`dithienyl`
Dithiodiglycolic acid	505-73-7	C4H6O4S2	`dithiodiglycolic-acid`
Divinyl sulfone	77-77-0	C4H6O2S	`divinyl-sulfone`
DL-2-(4-Chlorophenyl)propanoic acid	938-95-4	C9H9ClO2	`dl-2-4-chlorophenylpropanoic-acid`
dl-2-Amino-1-hexanol	5665-74-7	C6H15NO	`dl-2-amino-1-hexanol`
Dl-Alanine	1222-66-8	C3H7NO2	`dl-alanine`
DL-Arginine	7200-25-1	C6H14N4O2	`dl-arginine`
DL-Asparagine	3130-87-8	C4H8N2O3	`dl-asparagine`

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).