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SUGIOLE
SpectraBase Compound ID 8EJhiuUn6A4
InChI InChI=1S/C20H28O2/c1-12(2)13-9-14-15(10-16(13)21)20(5)8-6-7-19(3,4)18(20)11-17(14)22/h9-10,12,18,21H,6-8,11H2,1-5H3/t18-,20+/m0/s1
InChIKey IPEHJNRNYPOFII-AZUAARDMSA-N
Mol Weight 300.44 g/mol
Molecular Formula C20H28O2
Exact Mass 300.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FX4g2fN79Uu
Name Sugiol
Alternate Name(s) (4aS,10aS)-6-hydroxy-7-isopropyl-1,1,4a-trimethyl-2,3,4,4a,10,10a-hexahydrophenanthren-9(1H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28O2
InChI InChI=1S/C20H28O2/c1-12(2)13-9-14-15(10-16(13)21)20(5)8-6-7-19(3,4)18(20)11-17(14)22/h9-10,12,18,21H,6-8,11H2,1-5H3/t18-,20+/m0/s1
InChIKey IPEHJNRNYPOFII-AZUAARDMSA-N
Molecular Weight 300.442 g/mol
SMILES Oc1cc2[C@]3(CCCC([C@@]3(CC(c2cc1C(C)C)=O)[H])(C)C)C
SPLASH splash10-0uy0-0092000000-fb82560540a6dad59fb5
Source of Spectrum QA-33-248-12
Wiley ID 1794948