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3-Methylbenzoic acid (4-nitrophenyl) ester
SpectraBase Compound ID E7dPHRIQIQM
InChI InChI=1S/C14H11NO4/c1-10-3-2-4-11(9-10)14(16)19-13-7-5-12(6-8-13)15(17)18/h2-9H,1H3
InChIKey CWXGZYLOHXHWAL-UHFFFAOYSA-N
Mol Weight 257.24 g/mol
Molecular Formula C14H11NO4
Exact Mass 257.068808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ir0HtOIYbQe
Name 3-Methylbenzoic acid (4-nitrophenyl) ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H11NO4
InChI InChI=1S/C14H11NO4/c1-10-3-2-4-11(9-10)14(16)19-13-7-5-12(6-8-13)15(17)18/h2-9H,1H3
InChIKey CWXGZYLOHXHWAL-UHFFFAOYSA-N
Molecular Weight 257.245 g/mol
SMILES c1(N(=O)=O)ccc(OC(c2cc(C)ccc2)=O)cc1
SPLASH splash10-000i-0900000000-5a651048277a407202c6
Source of Spectrum OS-6-140-0
Synonyms m-Toluic acid, 4-nitrophenyl ester (4-nitrophenyl) 3-methylbenzoate
Wiley ID 1260761