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Benzoic acid, 4-[3-hydroxy-5-(methoxycarbonyl)phenoxy]-3-nitro-, methyl ester
SpectraBase Compound ID DMmIssFC4wn
InChI InChI=1S/C16H13NO8/c1-23-15(19)9-3-4-14(13(7-9)17(21)22)25-12-6-10(16(20)24-2)5-11(18)8-12/h3-8,18H,1-2H3
InChIKey HJZYXYDVUDGVJR-UHFFFAOYSA-N
Mol Weight 347.28 g/mol
Molecular Formula C16H13NO8
Exact Mass 347.064116 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5WQ2TuKOtuc
Name Benzoic acid, 4-[3-hydroxy-5-(methoxycarbonyl)phenoxy]-3-nitro-, methyl ester
CAS Registry Number 74683-27-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13NO8
InChI InChI=1S/C16H13NO8/c1-23-15(19)9-3-4-14(13(7-9)17(21)22)25-12-6-10(16(20)24-2)5-11(18)8-12/h3-8,18H,1-2H3
InChIKey HJZYXYDVUDGVJR-UHFFFAOYSA-N
Molecular Weight 347.279 g/mol
SMILES Oc1cc(cc(Oc2c(N(=O)=O)cc(C(=O)OC)cc2)c1)C(=O)OC
SPLASH splash10-001i-0924000000-2e01055f609311281ab0
Source of Spectrum F-36-531-0
Synonyms 3,4'-Dicarbomethoxy-5-hydroxy-2'-nitrodiphenyl ether Methyl 4-[3-hydroxy-5-(methoxycarbonyl)phenoxy]-3-nitrobenzoate
Wiley ID 1339910