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2-[(2-chloranyl-5-nitro-phenyl)carbonylamino]-4,5-dimethoxy-benzoic acid
SpectraBase Compound ID 4qn8V6Qy4zN
InChI InChI=1S/C16H13ClN2O7/c1-25-13-6-10(16(21)22)12(7-14(13)26-2)18-15(20)9-5-8(19(23)24)3-4-11(9)17/h3-7H,1-2H3,(H,18,20)(H,21,22)
InChIKey VMBOKBUQDOVXCJ-UHFFFAOYSA-N
Mol Weight 380.74 g/mol
Molecular Formula C16H13ClN2O7
Exact Mass 380.041128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1eeHIZydASR
Name 2-[(2-chloranyl-5-nitro-phenyl)carbonylamino]-4,5-dimethoxy-benzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13ClN2O7
InChI InChI=1S/C16H13ClN2O7/c1-25-13-6-10(16(21)22)12(7-14(13)26-2)18-15(20)9-5-8(19(23)24)3-4-11(9)17/h3-7H,1-2H3,(H,18,20)(H,21,22)
InChIKey VMBOKBUQDOVXCJ-UHFFFAOYSA-N
Molecular Weight 380.740 g/mol
SMILES N(C(c1cc(N(=O)=O)ccc1Cl)=O)c1c(C(=O)O)cc(c(c1)OC)OC
SPLASH splash10-001i-4903000000-c93230e4c7f4ec2ae410
Synonyms 2-[[(2-chloro-5-nitrophenyl)-oxomethyl]amino]-4,5-dimethoxybenzoic acid 2-[(2-chloro-5-nitrobenzoyl)amino]-4,5-dimethoxybenzoic acid
Wiley ID 1442744