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Estra-1,3,5(10)-trien-17-one, 2-hydroxy-3-methoxy-
SpectraBase Compound ID 4uVnKiwGafy
InChI InChI=1S/C19H24O3/c1-19-8-7-12-13(15(19)5-6-18(19)21)4-3-11-9-17(22-2)16(20)10-14(11)12/h9-10,12-13,15,20H,3-8H2,1-2H3
InChIKey YBCPNMOFBUWYTP-UHFFFAOYSA-N
Mol Weight 300.4 g/mol
Molecular Formula C19H24O3
Exact Mass 300.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AnKlBVmxRld
Name Estra-1,3,5(10)-trien-17-one, 2-hydroxy-3-methoxy-
Alternate Name(s) 2-Hydroxy-3-methoxyestra-1,3,5(10)-trien-17-one 2-Hydroxy-3-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one 3-Methoxy-13-methyl-2-oxidanyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
CAS Registry Number 5976-63-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H24O3
InChI InChI=1S/C19H24O3/c1-19-8-7-12-13(15(19)5-6-18(19)21)4-3-11-9-17(22-2)16(20)10-14(11)12/h9-10,12-13,15,20H,3-8H2,1-2H3
InChIKey YBCPNMOFBUWYTP-UHFFFAOYSA-N
Molecular Weight 300.398 g/mol
SMILES Oc1cc2c(cc1OC)CCC1C2CCC2(C)C1CCC2=O
SPLASH splash10-0udi-1869000000-54cf377e91039aa577a2
Source of Spectrum W5-27046-0-0
Wiley ID 1303213