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

*Links on SpectraBase are not permalinks.
(7aS)-3-tert-Butyl-7a-methyl-4,5,7,7a-tetrahydro-1H-inden-6(2H)-one
SpectraBase Compound ID 4qdIdzFuhh1
InChI InChI=1S/C14H22O/c1-13(2,3)11-7-8-14(4)9-10(15)5-6-12(11)14/h5-9H2,1-4H3/t14-/m0/s1
InChIKey ITLOYBWMOUAKSD-AWEZNQCLSA-N
Mol Weight 206.33 g/mol
Molecular Formula C14H22O
Exact Mass 206.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 87PnQi8P7Mh
Name (7aS)-3-tert-Butyl-7a-methyl-4,5,7,7a-tetrahydro-1H-inden-6(2H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O
InChI InChI=1S/C14H22O/c1-13(2,3)11-7-8-14(4)9-10(15)5-6-12(11)14/h5-9H2,1-4H3/t14-/m0/s1
InChIKey ITLOYBWMOUAKSD-AWEZNQCLSA-N
Literature Reference DOI 10.1002/anie.201409591
Molecular Weight 206.329 g/mol
SMILES C1[C@@]2(CCC(=C2CCC1=O)C(C)(C)C)C
SPLASH splash10-0002-2900000000-3957c822d0a44716626f
Source of Spectrum ACI-54-1960/SMS17-(S)_3
Synonyms (S)-3-(tert-butyl)-7a-methyl-4,5,7,7a-tetrahydro-1H-inden-6(2H)-one
Wiley ID 1761083