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3-Methylbenzoic acid phenyl ester
SpectraBase Compound ID 8uX2NEcsxZG
InChI InChI=1S/C14H12O2/c1-11-6-5-7-12(10-11)14(15)16-13-8-3-2-4-9-13/h2-10H,1H3
InChIKey YFLYQBATJQHBPI-UHFFFAOYSA-N
Mol Weight 212.25 g/mol
Molecular Formula C14H12O2
Exact Mass 212.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GQg0eINyKS8
Name 3-Methylbenzoic acid phenyl ester
CAS Registry Number 41998-14-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12O2
InChI InChI=1S/C14H12O2/c1-11-6-5-7-12(10-11)14(15)16-13-8-3-2-4-9-13/h2-10H,1H3
InChIKey YFLYQBATJQHBPI-UHFFFAOYSA-N
Molecular Weight 212.248 g/mol
SMILES c1(C(Oc2ccccc2)=O)cc(ccc1)C
SPLASH splash10-014i-9800000000-23a88a9bbadd48af6b9c
Synonyms m-Toluic acid, phenyl ester Phenyl 3-methylbenzoate
Wiley ID 1456919