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17H-Cyclopenta[a]phenanthren-17-one, 1,2,3,4,15,16-hexahydro-1,2,15-trihydroxy-11-methyl-
SpectraBase Compound ID 2fj2EUs03CK
InChI InChI=1S/C18H18O4/c1-8-6-11-13(20)7-14(21)17(11)10-4-2-9-3-5-12(19)18(22)16(9)15(8)10/h2,4,6,12,14,18-19,21-22H,3,5,7H2,1H3
InChIKey PYLRLUYGVCLKBQ-UHFFFAOYSA-N
Mol Weight 298.34 g/mol
Molecular Formula C18H18O4
Exact Mass 298.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GgH1yqFJvS1
Name 17H-Cyclopenta[a]phenanthren-17-one, 1,2,3,4,15,16-hexahydro-1,2,15-trihydroxy-11-methyl-
Alternate Name(s) 1,2,15-trihydroxy-11-methylgona-5(10),6,9(11),8(14),12-pentaen-17-one
CAS Registry Number 55081-22-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18O4
InChI InChI=1S/C18H18O4/c1-8-6-11-13(20)7-14(21)17(11)10-4-2-9-3-5-12(19)18(22)16(9)15(8)10/h2,4,6,12,14,18-19,21-22H,3,5,7H2,1H3
InChIKey PYLRLUYGVCLKBQ-UHFFFAOYSA-N
Molecular Weight 298.338 g/mol
SMILES OC1c2c3c(c4C(C(CCc4cc3)O)O)c(cc2C(C1)=O)C
SPLASH splash10-0019-0090000000-4bd970db1f2ef5e21a62
Source of Spectrum W5-0-0-0
Wiley ID 1301071