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3-BETA-HYDROXY-2-OXO-MANOYLOXID
SpectraBase Compound ID 9Rf7nbk6F24
InChI InChI=1S/C20H32O3/c1-7-18(4)10-8-15-19(5)12-13(21)16(22)17(2,3)14(19)9-11-20(15,6)23-18/h7,14-16,22H,1,8-12H2,2-6H3/t14-,15+,16-,18-,19-,20+/m0/s1
InChIKey WKRNXBWIIHEZTF-CJEFFJQMSA-N
Mol Weight 320.5 g/mol
Molecular Formula C20H32O3
Exact Mass 320.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6tLeTaqXYth
Name (3R,4aR,6aR,8R,10aS,10bR)-3-ethenyl-3,4a,7,7,10a-pentamethyl-8-oxidanyl-1,2,5,6,6a,8,10,10b-octahydrobenzo[f]chromen-9-one
CAS Registry Number 129134-90-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32O3
InChI InChI=1S/C20H32O3/c1-7-18(4)10-8-15-19(5)12-13(21)16(22)17(2,3)14(19)9-11-20(15,6)23-18/h7,14-16,22H,1,8-12H2,2-6H3/t14-,15+,16-,18-,19-,20+/m0/s1
InChIKey WKRNXBWIIHEZTF-CJEFFJQMSA-N
Molecular Weight 320.473 g/mol
SMILES O[C@]1(C(C[C@]2([C@](C1(C)C)(CC[C@@]1([C@@]2(CC[C@@](C=C)(C)O1)[H])C)[H])C)=O)[H]
SPLASH splash10-0592-8859000000-990ca5816ed3c2d0bc2f
Source of Spectrum B-43-793-3
Synonyms (3R,4aR,6aR,8R,10aS,10bR)-3-ethenyl-8-hydroxy-3,4a,7,7,10a-pentamethyl-1,2,5,6,6a,8,10,10b-octahydrobenzo[f]chromen-9-one (3R,4aR,6aR,8R,10aS,10bR)-3-ethenyl-8-hydroxy-3,4a,7,7,10a-pentamethyl-1,2,5,6,6a,8,10,10b-octahydrobenzo[f][1]benzopyran-9-one (3R,4aR,6aR,8R,10aS,10bR)-8-hydroxy-3,4a,7,7,10a-pentamethyl-3-vinyl-1,2,5,6,6a,8,10,10b-octahydrobenzo[f]chromen-9-one
Wiley ID 1320456