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Estra-1,3,5(10),6-tetraen-17-one, 3-hydroxy-6-methyl-
SpectraBase Compound ID 3m7vectm2ie
InChI InChI=1S/C19H22O2/c1-11-9-16-14(13-4-3-12(20)10-15(11)13)7-8-19(2)17(16)5-6-18(19)21/h3-4,9-10,14,16-17,20H,5-8H2,1-2H3
InChIKey LRKJTGSTYTYPDO-UHFFFAOYSA-N
Mol Weight 282.38 g/mol
Molecular Formula C19H22O2
Exact Mass 282.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FXHw3Nz7S4k
Name Estra-1,3,5(10),6-tetraen-17-one, 3-hydroxy-6-methyl-
CAS Registry Number 10506-91-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22O2
InChI InChI=1S/C19H22O2/c1-11-9-16-14(13-4-3-12(20)10-15(11)13)7-8-19(2)17(16)5-6-18(19)21/h3-4,9-10,14,16-17,20H,5-8H2,1-2H3
InChIKey LRKJTGSTYTYPDO-UHFFFAOYSA-N
Molecular Weight 282.383 g/mol
SMILES Oc1ccc2c(c1)C(C)=CC1C2CCC2(C)C1CCC2=O
SPLASH splash10-001i-0950000000-da48d024bc61acab2c57
Source of Spectrum DE-0-41-0
Synonyms 3-Hydroxy-6-methylestra-1,3,5(10),6-tetraen-17-one 3-Hydroxy-6,13-dimethyl-9,11,12,14,15,16-hexahydro-8H-cyclopenta[a]phenanthren-17-one 6,13-dimethyl-3-oxidanyl-9,11,12,14,15,16-hexahydro-8H-cyclopenta[a]phenanthren-17-one
Wiley ID 41371