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(13S,14R)-13-ethyl-3-methoxy-12,14,15,16-tetrahydro-11H-cyclopenta[a]phenanthren-17-one
SpectraBase Compound ID J6HGRRunPLN
InChI InChI=1S/C20H22O2/c1-3-20-11-10-16-15-7-5-14(22-2)12-13(15)4-6-17(16)18(20)8-9-19(20)21/h4-7,12,18H,3,8-11H2,1-2H3/t18-,20+/m1/s1
InChIKey XMTSNGBXOXCTCF-QUCCMNQESA-N
Mol Weight 294.39 g/mol
Molecular Formula C20H22O2
Exact Mass 294.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7tCiPDRAZfF
Name (13S,14R)-13-ethyl-3-methoxy-12,14,15,16-tetrahydro-11H-cyclopenta[a]phenanthren-17-one
CAS Registry Number 51262-25-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22O2
InChI InChI=1S/C20H22O2/c1-3-20-11-10-16-15-7-5-14(22-2)12-13(15)4-6-17(16)18(20)8-9-19(20)21/h4-7,12,18H,3,8-11H2,1-2H3/t18-,20+/m1/s1
InChIKey XMTSNGBXOXCTCF-QUCCMNQESA-N
Molecular Weight 294.394 g/mol
SMILES [C@@]12([C@@](c3ccc4c(c3CC2)ccc(OC)c4)(CCC1=O)[H])CC
SPLASH splash10-00ko-1490000000-15dbc6a1276e08eb2717
Source of Spectrum C-84-4549-14
Wiley ID 1297755