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(8S,13S,14S)-13-methyl-17-oxidanyl-2,6,7,8,14,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-3-one
SpectraBase Compound ID 8n1YCRjgfJI
InChI InChI=1S/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h8-10,15-17,20H,2-7H2,1H3/t15-,16+,17?,18+/m1/s1
InChIKey MEHHPFQKXOUFFV-BHGSFYIQSA-N
Mol Weight 270.37 g/mol
Molecular Formula C18H22O2
Exact Mass 270.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2t6Jfs9m6K
Name (8S,13S,14S)-13-methyl-17-oxidanyl-2,6,7,8,14,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-3-one
Alternate Name(s) (8S,13S,14S)-17-hydroxy-13-methyl-2,6,7,8,14,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22O2
InChI InChI=1S/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h8-10,15-17,20H,2-7H2,1H3/t15-,16+,17?,18+/m1/s1
InChIKey MEHHPFQKXOUFFV-BHGSFYIQSA-N
Molecular Weight 270.372 g/mol
SMILES OC1[C@]2(C=CC3=C4C(=CC(CC4)=O)CC[C@]3([C@@]2(CC1)[H])[H])C
SPLASH splash10-0v4m-0690000000-8885549493097d643b80
Source of Spectrum KO-13-122-0
Wiley ID 1274804