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6-Methyl-5-nitro-2H-isoindole-1-carboxylic acid ethyl ester
SpectraBase Compound ID LVE0UYIaxDe
InChI InChI=1S/C12H12N2O4/c1-3-18-12(15)11-9-4-7(2)10(14(16)17)5-8(9)6-13-11/h4-6,13H,3H2,1-2H3
InChIKey BJHXUDLUPTUMPK-UHFFFAOYSA-N
Mol Weight 248.24 g/mol
Molecular Formula C12H12N2O4
Exact Mass 248.079707 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID InaAYEGqiKw
Name 6-Methyl-5-nitro-2H-isoindole-1-carboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12N2O4
InChI InChI=1S/C12H12N2O4/c1-3-18-12(15)11-9-4-7(2)10(14(16)17)5-8(9)6-13-11/h4-6,13H,3H2,1-2H3
InChIKey BJHXUDLUPTUMPK-UHFFFAOYSA-N
Molecular Weight 248.238 g/mol
SMILES [nH]1cc2c(c1C(=O)OCC)cc(c(c2)N(=O)=O)C
SPLASH splash10-000j-0960000000-f3601f44a9ad22ab0729
Source of Spectrum KC-0-997-2
Synonyms Ethyl 6-methyl-5-nitro-2H-isoindole-1-carboxylate
Wiley ID 830315