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4,10a(1H)-Phenanthrenediol, 2-ethenyldodecahydro-2,4b,8,8-tetramethyl-, 4-acetate, [2S-(2.alpha.,4.alpha.,4a.alpha.,4b.beta.,8a.alpha.,10a.beta.)]-
SpectraBase Compound ID 79YmeSeSHqZ
InChI InChI=1S/C22H36O3/c1-7-20(5)13-16(25-15(2)23)18-21(6)11-8-10-19(3,4)17(21)9-12-22(18,24)14-20/h7,16-18,24H,1,8-14H2,2-6H3
InChIKey KLFJNJSJJCDMPP-UHFFFAOYSA-N
Mol Weight 348.5 g/mol
Molecular Formula C22H36O3
Exact Mass 348.266445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 68BFeyUuVoc
Name 4,10a(1H)-Phenanthrenediol, 2-ethenyldodecahydro-2,4b,8,8-tetramethyl-, 4-acetate, [2S-(2.alpha.,4.alpha.,4a.alpha.,4b.beta.,8a.alpha.,10a.beta.)]-
CAS Registry Number 41756-38-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H36O3
InChI InChI=1S/C22H36O3/c1-7-20(5)13-16(25-15(2)23)18-21(6)11-8-10-19(3,4)17(21)9-12-22(18,24)14-20/h7,16-18,24H,1,8-14H2,2-6H3
InChIKey KLFJNJSJJCDMPP-UHFFFAOYSA-N
Molecular Weight 348.527 g/mol
SMILES OC12C(C3(C)C(C(C)(C)CCC3)CC1)C(OC(C)=O)CC(C2)(C=C)C
SPLASH splash10-0596-9730000000-5822e4e4056f5075024d
Source of Spectrum EP-2892-0-0
Synonyms 8-Hydroxypimar-15-en-11-yl acetate (10a-hydroxy-2,4b,8,8-tetramethyl-2-vinyl-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthren-4-yl) acetate (2-ethenyl-10a-hydroxy-2,4b,8,8-tetramethyl-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthren-4-yl) acetate (2-ethenyl-2,4b,8,8-tetramethyl-10a-oxidanyl-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthren-4-yl) ethanoate Acetic acid (10a-hydroxy-2,4b,8,8-tetramethyl-2-vinyl-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthren-4-yl) ester Acetic acid (2-ethenyl-10a-hydroxy-2,4b,8,8-tetramethyl-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthren-4-yl) ester
Wiley ID 1340984