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 641–720 of 768 · formula C9–C12 · page 9/10

Name	CAS	Formula	Slug
o-Xylene-4-carboxylic Acid	619-04-5	C9H10O2	`o-xylene-4-carboxylic-acid`
Octanal dimethyl acetal	10022-28-3	C10H22O2	`octanal-dimethyl-acetal`
Octyl chloroformate	7452-59-7	C9H17ClO2	`octyl-chloroformate`
ortho-diacetylbenzene	704-00-7	C10H10O2	`ortho-diacetylbenzene`
P-Cymene	99-87-6	C10H14	`p-cymene`
p-Diacetylbenzene	1009-61-6	C10H10O2	`p-diacetylbenzene`
p-Menth-1-en-9-ol	18479-68-0	C10H18O	`p-menth-1-en-9-ol`
p-Menth-4(8)-en-3-one	15932-80-6	C10H16O	`p-menth-48-en-3-one`
p-Menthan-3-one	10458-14-7	C10H18O	`p-menthan-3-one`
p-Methylphenethylamine	3261-62-9	C9H13N	`p-methylphenethylamine`
p-Methyltetrahydroquinoline	91-61-2	C10H13N	`p-methyltetrahydroquinoline`
p-Phenylenediacetamide	140-50-1	C10H12N2O2	`p-phenylenediacetamide`
p-Phenylenediacetic acid	7325-46-4	C10H10O4	`p-phenylenediacetic-acid`
p-Phenylenediacetonitrile	622-75-3	C10H8N2	`p-phenylenediacetonitrile`
p-Propionotoluidide	2759-55-9	C10H13NO	`p-propionotoluidide`
p-Xylene Glycol Dimethyl Ether	6770-38-3	C10H14O2	`p-xylene-glycol-dimethyl-ether`
pemoline	2152-34-3	C9H8N2O2	`pemoline`
Pempidine	79-55-0	C10H21N	`pempidine`
Pennzone B	109-46-6	C9H20N2S	`pennzone-b`
Pentamethyldiethylenetriamine	3030-47-5	C9H23N3	`pentamethyldiethylenetriamine`
Pentylcyclopentane	3741-00-2	C10H20	`pentylcyclopentane`
Perillaldehyde	2111-75-3	C10H14O	`perillaldehyde`
Perillic acid	7694-45-3	C10H14O2	`perillic-acid`
Perillyl Alcohol	536-59-4	C10H16O	`perillyl-alcohol`
Phenethyl acetate	103-45-7	C10H12O2	`phenethyl-acetate`
Phenethyl isothiocyanate	2257-09-2	C9H9NS	`phenethyl-isothiocyanate`
Phenidone	92-43-3	C9H10N2O	`phenidone`
Phenoxyacetone	621-87-4	C9H10O2	`phenoxyacetone`
phentermine	122-09-8	C10H15N	`phentermine`
Phenyl propargyl ether	13610-02-1	C9H8O	`phenyl-propargyl-ether`
Phenylacetaldehyde dimethyl acetal	101-48-4	C10H14O2	`phenylacetaldehyde-dimethyl-acetal`
Phenylacetylglycine	500-98-1	C10H11NO3	`phenylacetylglycine`
Phenylmalonic acid	2613-89-0	C9H8O4	`phenylmalonic-acid`
Phenyltrimethylgermane	1626-00-2	C9H14Ge	`phenyltrimethylgermane`
Phorone	504-20-1	C9H14O	`phorone`
Phycoerythrin	11016-17-4	C10H16N5O13P3	`phycoerythrin`
Pinocarveol	5947-36-4	C10H16O	`pinocarveol`
prephenate	126-49-8	C10H10O6	`prephenate`
prometryn	7287-19-6	C10H19N5S	`prometryn`
propan-2-yl 4-aminobenzoate	18144-43-9	C10H13NO2	`propan-2-yl-4-aminobenzoate`
propanil	709-98-8	C9H9Cl2NO	`propanil`
Propargyloxy-t-butyldimethylsilane	76782-82-6	C9H18OSi	`propargyloxy-t-butyldimethylsilane`
Propyl 2-methylpentanoate	6639-14-1	C9H18O2	`propyl-2-methylpentanoate`
Propyl p-toluenesulfonate	599-91-7	C10H14O3S	`propyl-p-toluenesulfonate`
Propylbenzene	103-65-1	C9H12	`propylbenzene`
Propylene glycol dibutyrate	50980-84-2	C11H20O4	`propylene-glycol-dibutyrate`
psi-Pelletierine	28861-13-4	C9H15NO	`psi-pelletierine`
Pulegone	89-82-7	C10H16O	`pulegone`
Pyrogallol trimethyl ether	634-36-6	C9H12O3	`pyrogallol-trimethyl-ether`
Pyromellitic Acid	89-05-4	C10H6O8	`pyromellitic-acid`
Pyromellitic Dianhydride	89-32-7	C10H2O6	`pyromellitic-dianhydride`
Pyromellitic diimide	2550-73-4	C10H4N2O4	`pyromellitic-diimide`
Quinoline-3-boronic Acid	191162-39-7	C9H8BNO2	`quinoline-3-boronic-acid`
Quinoline-4-carbaldehyde	4363-93-3	C10H7NO	`quinoline-4-carbaldehyde`
Quinoline-6-carboxylic acid	10349-57-2	C10H7NO2	`quinoline-6-carboxylic-acid`
Racepinephrine	329-65-7	C9H13NO3	`racepinephrine`
Risocaine	94-12-2	C10H13NO2	`risocaine`
S acid	83-64-7	C10H9NO4S	`s-acid`
Sec-Butylbenzene	135-98-8	C10H14	`sec-butylbenzene`
serotonin	50-67-9	C10H12N2O	`serotonin`
spermine	71-44-3	C10H26N4	`spermine`
sulfamethoxazole	723-46-6	C10H11N3O3S	`sulfamethoxazole`
Surfynol 72	19549-98-5	C9H16O	`surfynol-72`
Surfynol 82	78-66-0	C10H18O2	`surfynol-82`
Syringaldehyde	134-96-3	C9H10O4	`syringaldehyde`
Tdbpp	126-72-7	C9H15Br6O4P	`tdbpp`
Tdcpp	13674-87-8	C9H15Cl6O4P	`tdcpp`
Terpinolene	586-62-9	C10H16	`terpinolene`
tert-Butylquinone	3602-55-9	C10H12O2	`tert-butylquinone`
Tetraacetylethylenediamine	10543-57-4	C10H16N2O4	`tetraacetylethylenediamine`
Tetraethyl orthocarbonate	78-09-1	C9H20O4	`tetraethyl-orthocarbonate`
Tetraethylurea	1187-03-7	C9H20N2O	`tetraethylurea`
tetrahydrobiopterin	17528-72-2	C9H15N5O3	`tetrahydrobiopterin`
Tetrahydroindene	3048-65-5	C9H12	`tetrahydroindene`
Tetrahydrolinalool	78-69-3	C10H22O	`tetrahydrolinalool`
Tetralin	119-64-2	C10H12	`tetralin`
Tetramethylene glutaric acid	16713-66-9	C9H14O4	`tetramethylene-glutaric-acid`
Thymoquinone	490-91-5	C10H12O2	`thymoquinone`
Tobias acid	81-16-3	C10H9NO3S	`tobias-acid`
Tosylacetonitrile	5697-44-9	C9H9NO2S	`tosylacetonitrile`

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).