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Isopropyl 4-methylbenzoate
SpectraBase Compound ID Cu0PXcECHhz
InChI InChI=1S/C11H14O2/c1-8(2)13-11(12)10-6-4-9(3)5-7-10/h4-8H,1-3H3
InChIKey ONWRVKPIVJMSHO-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 bbkiiZxEhz
Name Isopropyl para toluate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14O2
InChI InChI=1S/C11H14O2/c1-8(2)13-11(12)10-6-4-9(3)5-7-10/h4-8H,1-3H3
InChIKey ONWRVKPIVJMSHO-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 178.231 g/mol
SMILES CC(C)OC(=O)c1ccc(cc1)C
SPLASH splash10-014i-5900000000-27a8fc257cd189d46455
Source of Spectrum SRH-2022-51-0
Synonyms para-toluic acid isopropyl ester
Wiley ID 1822594