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p-toluic acid, methyl ester
SpectraBase Compound ID MdbpWmH7hJ
InChI InChI=1S/C9H10O2/c1-7-3-5-8(6-4-7)9(10)11-2/h3-6H,1-2H3
InChIKey QSSJZLPUHJDYKF-UHFFFAOYSA-N
Mol Weight 150.18 g/mol
Molecular Formula C9H10O2
Exact Mass 150.06808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID OtDtGD82f4
Name Benzoic acid, 4-methyl-, methyl ester
CAS Registry Number 99-75-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10O2
InChI InChI=1S/C9H10O2/c1-7-3-5-8(6-4-7)9(10)11-2/h3-6H,1-2H3
InChIKey QSSJZLPUHJDYKF-UHFFFAOYSA-N
Molecular Weight 150.177 g/mol
SMILES COC(=O)c1ccc(C)cc1
SPLASH splash10-014i-4900000000-3c04ddb30676c81ac674
Source of Spectrum UT-1990-1573-0
Synonyms 4-(Methoxycarbonyl)toluene Methyl 4-toluate Methyl ester of 4-methylbenzoic acid Methyl p-methylbenzoate Methyl p-toluate Methyl p-toluenecarboxylate P(methoxycarbonyl)toluene p-Carbomethoxytoluene p-Toluic acid, methyl ester p-Toluylic acid, methyl ester Methyl 4-methylbenzoate AI3-04243 BRN 1100609 CCRIS 6071 EINECS 202-784-1 HSDB 5327 NSC 24761
Wiley ID 1146936