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Spiro[7H-benz[e]indene-7,2'-[1,3]dioxolane]-6-ethanol, dodecahydro-3a,6-dimethyl-3-(2-methyl-1,3-dioxolan-2-yl)-, [3S-(3.alpha.,3a.alpha.,5a.beta.,6.beta.,9a.alpha.,9b.beta.)]-
SpectraBase Compound ID zUAV2CzuEl
InChI InChI=1S/C23H38O5/c1-20-8-7-18-16(17(20)4-5-19(20)22(3)25-12-13-26-22)6-9-23(27-14-15-28-23)21(18,2)10-11-24/h16-19,24H,4-15H2,1-3H3/t16-,17-,18-,19-,20-,21+/m0/s1
InChIKey YODKWYVNJGIMRQ-HXIANDDZSA-N
Mol Weight 394.6 g/mol
Molecular Formula C23H38O5
Exact Mass 394.271924 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BkAP7t3gKmw
Name Spiro[7H-benz[e]indene-7,2'-[1,3]dioxolane]-6-ethanol, dodecahydro-3a,6-dimethyl-3-(2-methyl-1,3-dioxolan-2-yl)-, [3S-(3.alpha.,3a.alpha.,5a.beta.,6.beta.,9a.alpha.,9b.beta.)]-
CAS Registry Number 81940-96-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H38O5
InChI InChI=1S/C23H38O5/c1-20-8-7-18-16(17(20)4-5-19(20)22(3)25-12-13-26-22)6-9-23(27-14-15-28-23)21(18,2)10-11-24/h16-19,24H,4-15H2,1-3H3/t16-,17-,18-,19-,20-,21+/m0/s1
InChIKey YODKWYVNJGIMRQ-HXIANDDZSA-N
Molecular Weight 394.552 g/mol
SMILES OCC[C@@]1([C@]2(CC[C@]3([C@]([C@@]2(CCC11OCCO1)[H])(CC[C@@]3(C1(OCCO1)C)[H])[H])C)[H])C
SPLASH splash10-000i-9000000000-42fbb05cc05a8e9609b6
Source of Spectrum KC-1982-516-0
Synonyms 2-[(1'S,2'S,5'S,6'S,9'S,10'R)-6',10'-dimethyl-5'-(2-methyl-1,3-dioxolan-2-yl)spiro[1,3-dioxolane-2,11'-tricyclo[7.4.0.0(2,6)]tridecane]-10'-yl]ethan-1-ol 5,5:20,20-bis(ethylenedioxy)-2,5-seco-2,4-dinorpregnan-2-ol
Wiley ID 1366743