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(2Z)-2-benzal-4-phenyl-but-3-ynoic acid
SpectraBase Compound ID 9MFkg2j1ZbJ
InChI InChI=1S/C17H12O2/c18-17(19)16(13-15-9-5-2-6-10-15)12-11-14-7-3-1-4-8-14/h1-10,13H,(H,18,19)/b16-13-
InChIKey BWMSVHVNLWJDBL-SSZFMOIBSA-N
Mol Weight 248.28 g/mol
Molecular Formula C17H12O2
Exact Mass 248.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HW7BmiWtPbt
Name (2Z)-2-benzal-4-phenyl-but-3-ynoic acid
Alternate Name(s) (2Z)-2-Benzylidene-4-phenyl-3-butynoic acid (2Z)-2-benzylidene-4-phenyl-but-3-ynoic acid (2Z)-4-phenyl-2-(phenylmethylene)-3-butynoic acid (2Z)-4-phenyl-2-(phenylmethylidene)but-3-ynoic acid 4-Pentynoic acid, 2-benzylidene-4-phenyl-
CAS Registry Number 134889-85-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12O2
InChI InChI=1S/C17H12O2/c18-17(19)16(13-15-9-5-2-6-10-15)12-11-14-7-3-1-4-8-14/h1-10,13H,(H,18,19)/b16-13-
InChIKey BWMSVHVNLWJDBL-SSZFMOIBSA-N
Molecular Weight 248.281 g/mol
SMILES OC(\C(C#Cc1ccccc1)=C/c1ccccc1)=O
SPLASH splash10-0udi-5790000000-cf8159d9f0efb2ff4c3c
Source of Spectrum HE-1982-0-0
Wiley ID 34721