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1H-4,10a-Ethanophenanthren-12-one, 2,3,4,4a,9,10-hexahydro-4a-hydroxy-4-methyl-, (4.alpha.,4a.alpha.,10a.alpha.)-(.+-.)-
SpectraBase Compound ID IU1RZmSrbHD
InChI InChI=1S/C17H20O2/c1-15-8-4-9-16(14(18)11-15)10-7-12-5-2-3-6-13(12)17(15,16)19/h2-3,5-6,19H,4,7-11H2,1H3/t15-,16-,17+/m1/s1
InChIKey LAULGVBWMXETLI-ZACQAIPSSA-N
Mol Weight 256.34 g/mol
Molecular Formula C17H20O2
Exact Mass 256.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 94B1GibDZS2
Name 1H-4,10a-Ethanophenanthren-12-one, 2,3,4,4a,9,10-hexahydro-4a-hydroxy-4-methyl-, (4.alpha.,4a.alpha.,10a.alpha.)-(.+-.)-
CAS Registry Number 78284-40-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20O2
InChI InChI=1S/C17H20O2/c1-15-8-4-9-16(14(18)11-15)10-7-12-5-2-3-6-13(12)17(15,16)19/h2-3,5-6,19H,4,7-11H2,1H3/t15-,16-,17+/m1/s1
InChIKey LAULGVBWMXETLI-ZACQAIPSSA-N
Molecular Weight 256.345 g/mol
SMILES O[C@@]12[C@@]3(C(=O)C[C@]2(CCC3)C)CCc2c1cccc2
SPLASH splash10-052b-0900000000-febbed65ee4c1677e8e3
Source of Spectrum KC-1981-1208-0
Synonyms (1S,10R,11R)-10-hydroxy-11-methyltetracyclo[9.3.2.0(1,10).0(4,9)]hexadeca-4,6,8-trien-15-one 4a.alpha.-hydroxy-4.beta.-methyl-1,2,3,4,4a,9,10,10a-octahydro-4,10a-ethanophenanthrene
Wiley ID 1260266