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Benzeneacetic acid, .alpha.-phenyl-, 1-propynyl ester
SpectraBase Compound ID BJyzUL4sK70
InChI InChI=1S/C17H14O2/c1-2-13-19-17(18)16(14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-12,16H,1H3
InChIKey WXDCAMFVEUQDIQ-UHFFFAOYSA-N
Mol Weight 250.3 g/mol
Molecular Formula C17H14O2
Exact Mass 250.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1v7a9wAA4zb
Name Benzeneacetic acid, .alpha.-phenyl-, 1-propynyl ester
CAS Registry Number 113779-51-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H14O2
InChI InChI=1S/C17H14O2/c1-2-13-19-17(18)16(14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-12,16H,1H3
InChIKey WXDCAMFVEUQDIQ-UHFFFAOYSA-N
Molecular Weight 250.297 g/mol
SMILES C(C(c1ccccc1)c1ccccc1)(=O)OC#CC
SPLASH splash10-014i-0900000000-6774499a7f389b21a661
Source of Spectrum C-110-3275-6
Synonyms 1-Propynyl diphenylacetate
Wiley ID 1254003