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6-Azaestra-1,3,5(10),6,8-pentaen-17-one, 3-methoxy-
SpectraBase Compound ID GqDf6UZBV3p
InChI InChI=1S/C18H19NO2/c1-18-8-7-12-13-4-3-11(21-2)9-16(13)19-10-14(12)15(18)5-6-17(18)20/h3-4,9-10,15H,5-8H2,1-2H3
InChIKey UQCQCKYXOVENII-UHFFFAOYSA-N
Mol Weight 281.36 g/mol
Molecular Formula C18H19NO2
Exact Mass 281.141579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EX8dzt2a47u
Name 6-Azaestra-1,3,5(10),6,8-pentaen-17-one, 3-methoxy-
CAS Registry Number 5144-20-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H19NO2
InChI InChI=1S/C18H19NO2/c1-18-8-7-12-13-4-3-11(21-2)9-16(13)19-10-14(12)15(18)5-6-17(18)20/h3-4,9-10,15H,5-8H2,1-2H3
InChIKey UQCQCKYXOVENII-UHFFFAOYSA-N
Molecular Weight 281.355 g/mol
SMILES CC12CCc3c4ccc(cc4ncc3C2CCC1=O)OC
SPLASH splash10-01qi-0090000000-669105e408c83ed82b7e
Source of Spectrum X-11-429-1
Synonyms 7-Methoxy-11a-methyl-2,3,3a,10,11,11a-hexahydro-1H-cyclopenta[i]phenanthridin-1-one 7-Methoxy-11a-methyl-3,3a,10,11-tetrahydro-2H-cyclopenta[i]phenanthridin-1-one
Wiley ID 1285033