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2-(3-Nitrophenyl)-2-oxoethyl 3-methoxybenzoate
SpectraBase Compound ID EVesmvYM5DQ
InChI InChI=1S/C16H13NO6/c1-22-14-7-3-5-12(9-14)16(19)23-10-15(18)11-4-2-6-13(8-11)17(20)21/h2-9H,10H2,1H3
InChIKey SHLKVQBPUBMAGS-UHFFFAOYSA-N
Mol Weight 315.28 g/mol
Molecular Formula C16H13NO6
Exact Mass 315.074287 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6ShEeGSlky9
Name 2-(3-Nitrophenyl)-2-oxoethyl 3-methoxybenzoate
CAS Registry Number 331277-43-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13NO6
InChI InChI=1S/C16H13NO6/c1-22-14-7-3-5-12(9-14)16(19)23-10-15(18)11-4-2-6-13(8-11)17(20)21/h2-9H,10H2,1H3
InChIKey SHLKVQBPUBMAGS-UHFFFAOYSA-N
Molecular Weight 315.281 g/mol
SMILES COc1cc(C(OCC(c2cc(N(=O)=O)ccc2)=O)=O)ccc1
SPLASH splash10-000i-3901000000-67ff56d7076f61ed1d0d
Source of Spectrum AD-0-2532-0
Synonyms Benzoic acid, 3-methoxy-, 2-(2-nitrophenyl-2-oxo)ethyl ester 3-Methoxybenzoic acid [2-(3-nitrophenyl)-2-oxoethyl] ester [2-(3-nitrophenyl)-2-oxoethyl] 3-methoxybenzoate [2-(3-nitrophenyl)-2-oxo-ethyl] 3-methoxybenzoate [2-(3-nitrophenyl)-2-oxidanylidene-ethyl] 3-methoxybenzoate
Wiley ID 1425012