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2-Propynoic acid, 3-phenyl-, phenylmethyl ester
SpectraBase Compound ID 6XlANFgfPkQ
InChI InChI=1S/C16H12O2/c17-16(12-11-14-7-3-1-4-8-14)18-13-15-9-5-2-6-10-15/h1-10H,13H2
InChIKey GORVLYAFPYWZFS-UHFFFAOYSA-N
Mol Weight 236.27 g/mol
Molecular Formula C16H12O2
Exact Mass 236.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L1tvb8U2RDv
Name 2-Propynoic acid, 3-phenyl-, phenylmethyl ester
CAS Registry Number 63888-21-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12O2
InChI InChI=1S/C16H12O2/c17-16(12-11-14-7-3-1-4-8-14)18-13-15-9-5-2-6-10-15/h1-10H,13H2
InChIKey GORVLYAFPYWZFS-UHFFFAOYSA-N
Molecular Weight 236.270 g/mol
SMILES C(#Cc1ccccc1)C(=O)OCc1ccccc1
SPLASH splash10-0fbc-6900000000-b50ef3ee83f48ae37c52
Source of Spectrum I-58-1149-0
Synonyms (phenylmethyl) 3-phenylprop-2-ynoate 3-Phenyl-2-propynoic acid (phenylmethyl) ester 3-Phenylpropiolic acid benzyl ester benzyl 3-phenylprop-2-ynoate
Wiley ID 1238885