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(3S*,3aR*,4S*,7aS*)-3-Benzyl-7-methyleneoctahydro-1H-inden-4-yl acetate
SpectraBase Compound ID 4lkZkD5rMHd
InChI InChI=1S/C19H24O2/c1-13-8-11-18(21-14(2)20)19-16(9-10-17(13)19)12-15-6-4-3-5-7-15/h3-7,16-19H,1,8-12H2,2H3/t16-,17+,18-,19+/m0/s1
InChIKey JTGVXTAYADJHMW-ZSYWTGECSA-N
Mol Weight 284.4 g/mol
Molecular Formula C19H24O2
Exact Mass 284.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DFOh2nBrUGJ
Name (3S*,3aR*,4S*,7aS*)-3-Benzyl-7-methyleneoctahydro-1H-inden-4-yl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H24O2
InChI InChI=1S/C19H24O2/c1-13-8-11-18(21-14(2)20)19-16(9-10-17(13)19)12-15-6-4-3-5-7-15/h3-7,16-19H,1,8-12H2,2H3/t16-,17+,18-,19+/m0/s1
InChIKey JTGVXTAYADJHMW-ZSYWTGECSA-N
Ionization Type EI
Literature Reference DOI 10.1021/ml300283f
Molecular Weight 284.399 g/mol
Reported Formula C19H24O2
SMILES [C@@]1(CC[C@]2([C@@]1([C@](CCC2=C)(OC(C)=O)[H])[H])[H])(Cc1ccccc1)[H]
SPLASH splash10-001i-3920000000-3e93588f7f88f56f5f78
Source of Spectrum MCS-3-SM10-8d
Wiley ID 1864125