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6-Methyl-2-(4-nitrophenyl)-7-[(4-nitrophenyl)methyl]indolizine
SpectraBase Compound ID 6LIbDnaSiQC
InChI InChI=1S/C22H17N3O4/c1-15-13-23-14-19(17-4-8-21(9-5-17)25(28)29)12-22(23)11-18(15)10-16-2-6-20(7-3-16)24(26)27/h2-9,11-14H,10H2,1H3
InChIKey KELIVBRDVHXKFK-UHFFFAOYSA-N
Mol Weight 387.4 g/mol
Molecular Formula C22H17N3O4
Exact Mass 387.121906 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7ccbRVgTRP0
Name 6-Methyl-2-(4-nitrophenyl)-7-[(4-nitrophenyl)methyl]indolizine
Alternate Name(s) 6-Methyl-7-(4-nitrobenzyl)-2-(4-nitrophenyl)indolizine
CAS Registry Number 70586-13-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H17N3O4
InChI InChI=1S/C22H17N3O4/c1-15-13-23-14-19(17-4-8-21(9-5-17)25(28)29)12-22(23)11-18(15)10-16-2-6-20(7-3-16)24(26)27/h2-9,11-14H,10H2,1H3
InChIKey KELIVBRDVHXKFK-UHFFFAOYSA-N
Molecular Weight 387.395 g/mol
SMILES c12[n](cc(c2)-c2ccc(N(=O)=O)cc2)C=C(C(=C1)Cc1ccc(N(=O)=O)cc1)C
SPLASH splash10-000i-1019000000-7a75c0303514d726d338
Source of Spectrum HC-17-1027-0
Wiley ID 1363410