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3-Hydroxyestra-1(10),2,4,15-tetraen-17-one
SpectraBase Compound ID DR5SKbGLl4H
InChI InChI=1S/C18H20O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5-7,10,14-16,19H,2,4,8-9H2,1H3
InChIKey CCMDDSSGLUJFMA-UHFFFAOYSA-N
Mol Weight 268.36 g/mol
Molecular Formula C18H20O2
Exact Mass 268.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4zc9anyMOTb
Name 3-Hydroxyestra-1(10),2,4,15-tetraen-17-one
Alternate Name(s) Estra-1,3,5(10),15-tetraen-17-one, 3-hydroxy- 13-Methyl-3-oxidanyl-7,8,9,11,12,14-hexahydro-6H-cyclopenta[a]phenanthren-17-one 3-Hydroxy-13-methyl-7,8,9,11,12,14-hexahydro-6H-cyclopenta[a]phenanthren-17-one Estra-1,3,5(10),15-tetraen-17-one, 3-hydroxy-, (14.beta.)-
CAS Registry Number 3563-25-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20O2
InChI InChI=1S/C18H20O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5-7,10,14-16,19H,2,4,8-9H2,1H3
InChIKey CCMDDSSGLUJFMA-UHFFFAOYSA-N
Molecular Weight 268.356 g/mol
SMILES Oc1ccc2c(c1)CCC1C2CCC2(C)C1C=CC2=O
SPLASH splash10-014i-1970000000-13cda9144da6b50f5dc8
Source of Spectrum W5-0-0-0
Wiley ID 1272649