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7-(3,4,5-Trimethoxy-phenyl)-1,2,3,4-tetrahydro-10H-9-oxa-11-aza-cyclopenta[b]phenanthren-8-one
SpectraBase Compound ID 3qvRRHDDeZ8
InChI InChI=1S/C24H23NO5/c1-27-18-10-14(11-19(28-2)23(18)29-3)20-16-9-8-13-6-4-5-7-15(13)22(16)25-17-12-30-24(26)21(17)20/h8-11H,4-7,12H2,1-3H3
InChIKey XESLPORLQQMLED-UHFFFAOYSA-N
Mol Weight 405.45 g/mol
Molecular Formula C24H23NO5
Exact Mass 405.157623 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FiJ2OhpLH9W
Name 7-(3,4,5-Trimethoxy-phenyl)-1,2,3,4-tetrahydro-10H-9-oxa-11-aza-cyclopenta[b]phenanthren-8-one
Appearance White solid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H23NO5
InChI InChI=1S/C24H23NO5/c1-27-18-10-14(11-19(28-2)23(18)29-3)20-16-9-8-13-6-4-5-7-15(13)22(16)25-17-12-30-24(26)21(17)20/h8-11H,4-7,12H2,1-3H3
InChIKey XESLPORLQQMLED-UHFFFAOYSA-N
Instrument Name Finnigan MAT/INCOS 50
Ionization Type EI
Literature Reference DOI 10.1021/jm200737s
Molecular Weight 405.450 g/mol
SMILES c12c(c3c(cc2)c(c2c(n3)COC2=O)-c2cc(c(c(c2)OC)OC)OC)CCCC1
SPLASH splash10-0pbc-0961500000-c16c4c4271920da08107
Source of Spectrum AF-54-SM19-11'a
Wiley ID 1851907