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Benzeneacetic acid, .alpha.,.alpha.-dimethyl-, methyl ester
SpectraBase Compound ID KhIOlvT32ZJ
InChI InChI=1S/C11H14O2/c1-11(2,10(12)13-3)9-7-5-4-6-8-9/h4-8H,1-3H3
InChIKey WITYUUTUSPKOAB-UHFFFAOYSA-N
Mol Weight 178.23 g/mol
Molecular Formula C11H14O2
Exact Mass 178.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K97vQSJXCc1
Name Benzeneacetic acid, .alpha.,.alpha.-dimethyl-, methyl ester
CAS Registry Number 57625-74-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14O2
InChI InChI=1S/C11H14O2/c1-11(2,10(12)13-3)9-7-5-4-6-8-9/h4-8H,1-3H3
InChIKey WITYUUTUSPKOAB-UHFFFAOYSA-N
Molecular Weight 178.231 g/mol
SMILES C(C(=O)OC)(c1ccccc1)(C)C
SPLASH splash10-014i-2900000000-ca541b7dbd2f81240f0f
Source of Spectrum F4-40-3842-3b
Synonyms 2-Methyl-2-phenyl-propionic acid methyl ester Methyl 2-methyl-2-phenylpropionate 2-Methyl-2-phenylpropanoic acid methyl ester Methyl 2-methyl-2-phenylpropanoate Methyl 2-methyl-2-phenyl-propanoate
Wiley ID 1671423