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BUTYRIC ACID, 2-PHENYL-, ETHYL ESTER
SpectraBase Compound ID E2Zyvaqx9Um
InChI InChI=1S/C12H16O2/c1-3-11(12(13)14-4-2)10-8-6-5-7-9-10/h5-9,11H,3-4H2,1-2H3
InChIKey CLLUFLLBRNCOLB-UHFFFAOYSA-N
Mol Weight 192.26 g/mol
Molecular Formula C12H16O2
Exact Mass 192.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K44SWXwKaBW
Name Benzeneacetic acid, .alpha.-ethyl-, ethyl ester
Alternate Name(s) Butyric acid, 2-phenyl-, ethyl ester 2-Phenylbutanoic acid ethyl ester 2-Phenylbutyric acid ethyl ester Ethyl .alpha.-phenylbutyrate Ethyl 2-phenylbutanoate Ethyl 2-phenylbutyrate AI3-05890 EINECS 204-324-5 NSC 30680
CAS Registry Number 119-43-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O2
InChI InChI=1S/C12H16O2/c1-3-11(12(13)14-4-2)10-8-6-5-7-9-10/h5-9,11H,3-4H2,1-2H3
InChIKey CLLUFLLBRNCOLB-UHFFFAOYSA-N
Molecular Weight 192.258 g/mol
SMILES CCC(C(=O)OCC)c1ccccc1
SPLASH splash10-00kf-9800000000-cd805dd708eb4a50658f
Source of Spectrum J-41-213-0
Wiley ID 1188571