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Ethyl 2-chloro-8-(2-nitrophenyl)-1-azaazulene-3-carboxylate
SpectraBase Compound ID L3Ymcvmdjav
InChI InChI=1S/C18H13ClN2O4/c1-2-25-18(22)15-13-9-4-3-8-12(16(13)20-17(15)19)11-7-5-6-10-14(11)21(23)24/h3-10H,2H2,1H3
InChIKey QBJVELIXMDZFPF-UHFFFAOYSA-N
Mol Weight 356.77 g/mol
Molecular Formula C18H13ClN2O4
Exact Mass 356.056385 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dah0bZD2HXw
Name Ethyl 2-chloro-8-(2-nitrophenyl)-1-azaazulene-3-carboxylate
Alternate Name(s) Ethyl 2-chloro-8-(2-nitrophenyl)cyclohepta[b]pyrrole-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H13ClN2O4
InChI InChI=1S/C18H13ClN2O4/c1-2-25-18(22)15-13-9-4-3-8-12(16(13)20-17(15)19)11-7-5-6-10-14(11)21(23)24/h3-10H,2H2,1H3
InChIKey QBJVELIXMDZFPF-UHFFFAOYSA-N
Molecular Weight 356.765 g/mol
SMILES c1(nc2c(ccccc2c1C(=O)OCC)-c1c(cccc1)N(=O)=O)Cl
SPLASH splash10-03e9-0097000000-31809d2745989f4130cb
Source of Spectrum H1-54-335-6
Wiley ID 1564356