For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Benzeneacetic acid, 4-nitro-, 3-methylphenyl ester
SpectraBase Compound ID 6uV8hmuauVL
InChI InChI=1S/C15H13NO4/c1-11-3-2-4-14(9-11)20-15(17)10-12-5-7-13(8-6-12)16(18)19/h2-9H,10H2,1H3
InChIKey YZTRXQNRHORALX-UHFFFAOYSA-N
Mol Weight 271.27 g/mol
Molecular Formula C15H13NO4
Exact Mass 271.084458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID IoTTRPNf4TK
Name Benzeneacetic acid, 4-nitro-, 3-methylphenyl ester
CAS Registry Number 53218-12-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H13NO4
InChI InChI=1S/C15H13NO4/c1-11-3-2-4-14(9-11)20-15(17)10-12-5-7-13(8-6-12)16(18)19/h2-9H,10H2,1H3
InChIKey YZTRXQNRHORALX-UHFFFAOYSA-N
Molecular Weight 271.272 g/mol
SMILES c1(N(=O)=O)ccc(CC(Oc2cc(C)ccc2)=O)cc1
SPLASH splash10-00di-0290000000-5ad02af423fa5b3f41d6
Source of Spectrum W5-24229-0-0
Synonyms 3-Methylphenyl (4-nitrophenyl)acetate M-tolyl (p-nitrophenyl) acetate 2-(4-nitrophenyl)acetic acid (3-methylphenyl) ester (3-methylphenyl) 2-(4-nitrophenyl)acetate m-Tolyl 2-(4-nitrophenyl)acetate (3-methylphenyl) 2-(4-nitrophenyl)ethanoate
Wiley ID 1275259