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16-Hydroxyschellhammeran-12-one
SpectraBase Compound ID BCJ0uYoYshC
InChI InChI=1S/C17H21NO2/c19-13-6-7-14-15(10-13)17-8-2-1-4-12(17)5-3-9-18(17)11-16(14)20/h6-7,10,12,19H,1-5,8-9,11H2/t12-,17-/m0/s1
InChIKey BSAVEFCNTPTHBD-SJCJKPOMSA-N
Mol Weight 271.36 g/mol
Molecular Formula C17H21NO2
Exact Mass 271.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H6je2ZB6eql
Name 16-Hydroxyschellhammeran-12-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21NO2
InChI InChI=1S/C17H21NO2/c19-13-6-7-14-15(10-13)17-8-2-1-4-12(17)5-3-9-18(17)11-16(14)20/h6-7,10,12,19H,1-5,8-9,11H2/t12-,17-/m0/s1
InChIKey BSAVEFCNTPTHBD-SJCJKPOMSA-N
Molecular Weight 271.360 g/mol
SMILES Oc1cc2[C@]34N(CC(c2cc1)=O)CCC[C@@]4(CCCC3)[H]
SPLASH splash10-004i-0090000000-40b70cbcc6fdb4717897
Source of Spectrum AH-135-968-5
Wiley ID 1576595