For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

acetic acid [(3aR,7aR)-1-(benzyl)-6-keto-2,3,7,7a-tetrahydroindol-3a-yl]methyl ester

Compound with spectra: 1 NMR, and 1 MS (GC)

acetic acid [(3aR,7aR)-1-(benzyl)-6-keto-2,3,7,7a-tetrahydroindol-3a-yl]methyl ester
SpectraBase Compound ID E6RN4IjBuyA
InChI InChI=1S/C18H21NO3/c1-14(20)22-13-18-8-7-16(21)11-17(18)19(10-9-18)12-15-5-3-2-4-6-15/h2-8,17H,9-13H2,1H3/t17-,18-/m1/s1
InChIKey RMRBYVMQIXJHDB-QZTJIDSGSA-N
Mol Weight 299.37 g/mol
Molecular Formula C18H21NO3
Exact Mass 299.152144 g/mol
Enantiomer InChIKey RMRBYVMQIXJHDB-ROUUACIJSA-N

View Spectrum of acetic acid [(3aR,7aR)-1-(benzyl)-6-keto-2,3,7,7a-tetrahydroindol-3a-yl]methyl ester

MS (GC) Spectrum
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum J-57-6044-25

View Spectrum of acetic acid [(3aR,7aR)-1-(benzyl)-6-keto-2,3,7,7a-tetrahydroindol-3a-yl]methyl ester

13C NMR Spectrum
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
  • 1-(Acetoxymethyl)-7-benzyl-7-azabicyclo[4.3.0]non-2-en-4-one
  • Acetic acid (3aR,7aR)-1-benzyl-6-oxo-1,2,3,6,7,7a-hexahydro-indol-3a-ylmethyl ester
  • Acetic acid [(3aR,7aR)-6-oxo-1-(phenylmethyl)-2,3,7,7a-tetrahydroindol-3a-yl]methyl ester
  • [(3aR,7aR)-1-benzyl-6-oxo-2,3,7,7a-tetrahydroindol-3a-yl]methyl acetate
  • [(3aR,7aR)-6-oxidanylidene-1-(phenylmethyl)-2,3,7,7a-tetrahydroindol-3a-yl]methyl ethanoate
  • (1-benzyl-6-oxo-1,2,3,6,7,7a-hexahydro-3aH-indol-3a-yl)methyl acetate
4'-o-Methyl-sceletone P643
6H-Indol-6-one, 1,2,3,3a,7,7a-hexahydro-3a-(4-methoxyphenyl)-1-methyl-, (3aR-cis)-
Sceletenone
Sceletone
(4aR,8aR)-Ethyl 4a-fluoro-7-oxo-3,4,4a,7,8,8a-hexahydro-2H-quinoline-1-carboxylate
N-Benzyl-3,4-dimethyl-2-[(2''-oxo-4''-benzyloxazol-2''-yl)2'-oxoethyl]piperidine
(4ar*,5ar*,8as*)-1-Benzyl-2,3,5,5A,6,7,8,8A-octahydrocyclopropa-[E]-quinolin-4-(1H)-one
(1S,3aR,6R,7aR)-1-Benzyl-6-isopropenyl-3,3a-dimethyl-2,3,3a,6,7,7a-hexahydroindole
METHYL-(1S,2S,5S,ALPHA-S)-2-N-BENZYL-N-ALPHA-METHYLBENZYLAMINO-5-CARBOXYMETHYL-CYCLOPENTANE-1-CARBOXYLATE
DITHIOCARBONIC-ACID-O-ETHYLESTER-S-[1-(4-METHOXYBENZYL)-2-OXO-OCTAHYDRO-INDOL-7-YL]-ESTER
Title Journal or Book Year
Exploratory studies of .alpha.-silylamino- and .alpha.-silylamido-2,5-cyclohexadien-1-one SET photochemistry. Methodology for synthesis of functionalized hydroisoquinolines The Journal of Organic Chemistry 1992
Other Resources
Unknown Identification

Search your unknown spectrum against the world's largest collection of reference spectra

KnowItAll Campus Solutions

KnowItAll offers faculty and students at your school access to all the tools you need for spectral analysis and structure drawing & publishing! Plus, access the world's largest spectral library.