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Incisterol
SpectraBase Compound ID Bs9DIcvaRem
InChI InChI=1S/C21H32O3/c1-14(2)7-6-8-15(3)16-9-10-17-18-13-19(22)24-21(18,23-5)12-11-20(16,17)4/h6,8,13-17H,7,9-12H2,1-5H3/b8-6+/t15-,16?,17?,20-,21+/m1/s1
InChIKey WZZDRLYBOFXMBP-ZUJYMDHESA-N
Mol Weight 332.5 g/mol
Molecular Formula C21H32O3
Exact Mass 332.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID vH6Or8DEst
Name Incisterol
CAS Registry Number 125974-95-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32O3
InChI InChI=1S/C21H32O3/c1-14(2)7-6-8-15(3)16-9-10-17-18-13-19(22)24-21(18,23-5)12-11-20(16,17)4/h6,8,13-17H,7,9-12H2,1-5H3/b8-6+/t15-,16?,17?,20-,21+/m1/s1
InChIKey WZZDRLYBOFXMBP-ZUJYMDHESA-N
Molecular Weight 332.484 g/mol
SMILES [C@@]12(C(C3CCC([C@]3(CC2)C)[C@@](\C=C\CC(C)C)(C)[H])=CC(O1)=O)OC
SPLASH splash10-0pw9-0195000000-87eded9fbefabaa410d1
Source of Spectrum C-112-3508-1
Synonyms (3aS,5aR)-6-[(1R,2E)-1,5-dimethyl-2-hexenyl]-3a-methoxy-5a-methyl-3a,4,5,5a,6,7,8,8a-octahydro-2H-indeno[5,4-b]furan-2-one
Wiley ID 1329805