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7-(3-(4-Hydroxy-3-methoxyphenyl)-1-oxo-prop-2-en-1-yl)-8-(2-(4-hydroxy-3-methoxyphenyl)ethen-1-yl)-2,4-dimethyl-1,5,6,8a,9-pentaazafluorene

View entire compound with spectra: 1 MS (GC)

7-(3-(4-Hydroxy-3-methoxyphenyl)-1-oxo-prop-2-en-1-yl)-8-(2-(4-hydroxy-3-methoxyphenyl)ethen-1-yl)-2,4-dimethyl-1,5,6,8a,9-pentaazafluorene
SpectraBase Compound ID HeHuot8FusX
InChI InChI=1S/C29H25N5O5/c1-16-13-17(2)30-28-26(16)29-32-31-27(23(37)12-8-19-7-11-22(36)25(15-19)39-4)20(34(29)33-28)9-5-18-6-10-21(35)24(14-18)38-3/h5-15,35-36H,1-4H3/b9-5+,12-8+
InChIKey MWBDHORORPEONY-PIHCAMFYSA-N
Mol Weight 523.55 g/mol
Molecular Formula C29H25N5O5
Exact Mass 523.185569 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1yxHk2hPT2a
Name 7-(3-(4-Hydroxy-3-methoxyphenyl)-1-oxo-prop-2-en-1-yl)-8-(2-(4-hydroxy-3-methoxyphenyl)ethen-1-yl)-2,4-dimethyl-1,5,6,8a,9-pentaazafluorene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H25N5O5
InChI InChI=1S/C29H25N5O5/c1-16-13-17(2)30-28-26(16)29-32-31-27(23(37)12-8-19-7-11-22(36)25(15-19)39-4)20(34(29)33-28)9-5-18-6-10-21(35)24(14-18)38-3/h5-15,35-36H,1-4H3/b9-5+,12-8+
InChIKey MWBDHORORPEONY-PIHCAMFYSA-N
Literature Reference DOI 10.1002/ardp.201300203
Molecular Weight 523.549 g/mol
SMILES Oc1ccc(\C=C\C2=C(C(\C=C\c3cc(c(cc3)O)OC)=O)N=Nc3[n]2nc2c3c(cc(n2)C)C)cc1OC
SPLASH splash10-00di-3900000000-425ca8b79fecb7155a13
Source of Spectrum APC-347-130-10
Synonyms (E)-3-(4-hydroxy-3-methoxyphenyl)-1-(4-((E)-4-hydroxy-3-methoxystyryl)-8,10-dimethylpyrido[2',3':3,4]pyrazolo[5,1-c][1,2,4]triazin-3-yl)prop-2-en-1-one
Wiley ID 1769568