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METHYL-3-METHOXY-11-METHYL-17-OXO-AZAESTRA-1,2,5(10),6,8-PENTAENE-6-CARBOXYLATE
SpectraBase Compound ID LYlNEzsMa2Z
InChI InChI=1S/C21H23NO4/c1-21-11-22(2)19-13-6-5-12(25-3)9-14(13)15(20(24)26-4)10-16(19)17(21)7-8-18(21)23/h5-6,9-10,17H,7-8,11H2,1-4H3/t17-,21-/m0/s1
InChIKey UTBQTXNWKBWWGC-UWJYYQICSA-N
Mol Weight 353.42 g/mol
Molecular Formula C21H23NO4
Exact Mass 353.162708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4Ter8m9PtvA
Name Methyl 3-methoxy-11-methyl-17-oxo-11-azaestra-1,3,5(10),6,8-pentaene-6-carboxylate
Alternate Name(s) Methyl (6aR,9aS)-2-methoxy-5,6a-dimethyl-7-oxo-6,6a,7,8,9,9a-hexahydro-5H-benzo[h]cyclopenta[c]quinoline-11-carboxylate Methyl 3-methoxy-11-methyl-17-oxo-11-azaestra-1,3,5(10),6,8-pentaene-6-carbocylate
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Formula C21H23NO4
InChI InChI=1S/C21H23NO4/c1-21-11-22(2)19-13-6-5-12(25-3)9-14(13)15(20(24)26-4)10-16(19)17(21)7-8-18(21)23/h5-6,9-10,17H,7-8,11H2,1-4H3/t17-,21-/m0/s1
InChIKey UTBQTXNWKBWWGC-UWJYYQICSA-N
Molecular Weight 353.418 g/mol
SMILES [C@@]12([C@](c3cc(C(=O)OC)c4c(c3N(C2)C)ccc(OC)c4)(CCC1=O)[H])C
SPLASH splash10-007k-0089000000-086597ce204de914e3f6
Source of Spectrum KC-0-67-26
Wiley ID 827258