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Benzoic acid isopropyl ester
SpectraBase Compound ID IIiqLhO0hHM
InChI InChI=1S/C10H12O2/c1-8(2)12-10(11)9-6-4-3-5-7-9/h3-8H,1-2H3
InChIKey FEXQDZTYJVXMOS-UHFFFAOYSA-N
Mol Weight 164.2 g/mol
Molecular Formula C10H12O2
Exact Mass 164.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IgFuSqE7qNl
Name Isopropyl benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 164.083729624 u
Formula C10H12O2
InChI InChI=1S/C10H12O2/c1-8(2)12-10(11)9-6-4-3-5-7-9/h3-8H,1-2H3
InChIKey FEXQDZTYJVXMOS-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/chem.201606048
Molecular Weight 164.204 g/mol
Quality 172
SMILES C(C)(C)OC(C1=CC=CC=C1)=O
SPLASH splash10-0a6r-5900000000-24f31ede59aca5eeba2c
Source of Spectrum QE-23-SM1-Table 3, Entry 1 (DOI: 10.1002/chem.201606048)
Wiley ID 1905543