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3-Methyl-7-(4-nitrobenzoyl)pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylic acid dimethyl ester
SpectraBase Compound ID hWw8okY1yK
InChI InChI=1S/C19H15N3O7/c1-10-8-13-14(18(24)28-2)15(19(25)29-3)16(21(13)9-20-10)17(23)11-4-6-12(7-5-11)22(26)27/h4-9H,1-3H3
InChIKey CJOAHPYNUWWWQE-UHFFFAOYSA-N
Mol Weight 397.34 g/mol
Molecular Formula C19H15N3O7
Exact Mass 397.091 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ITYDSlvQ2GC
Name 3-Methyl-7-(4-nitrobenzoyl)pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylic acid dimethyl ester
Alternate Name(s) 3-Methyl-7-[(4-nitrophenyl)-oxomethyl]pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylic acid dimethyl ester Dimethyl 3-methyl-7-(4-nitrobenzoyl)pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylate Dimethyl 3-methyl-7-(4-nitrophenyl)carbonyl-pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H15N3O7
InChI InChI=1S/C19H15N3O7/c1-10-8-13-14(18(24)28-2)15(19(25)29-3)16(21(13)9-20-10)17(23)11-4-6-12(7-5-11)22(26)27/h4-9H,1-3H3
InChIKey CJOAHPYNUWWWQE-UHFFFAOYSA-N
Molecular Weight 397.343 g/mol
SMILES c1(c(c(C(c2ccc(N(=O)=O)cc2)=O)[n]2c1C=C(N=C2)C)C(=O)OC)C(=O)OC
SPLASH splash10-000b-0095000000-07e9117e665107176cf5
Source of Spectrum SO-0-2049-4
Wiley ID 878428