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(Z)-2-(2-Phenylethyl)-4-phenyl-1-(p-tolylsulfinyl)but-1-en-3-yne
SpectraBase Compound ID 2Wtye8VfZyQ
InChI InChI=1S/C25H22OS/c1-21-12-18-25(19-13-21)27(26)20-24(16-14-22-8-4-2-5-9-22)17-15-23-10-6-3-7-11-23/h2-13,18-20H,14,16H2,1H3/b24-20-
InChIKey JOPHUWPVURBTJM-GFMRDNFCSA-N
Mol Weight 370.51 g/mol
Molecular Formula C25H22OS
Exact Mass 370.139137 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6GGBwCRcTXq
Name (Z)-2-(2-Phenylethyl)-4-phenyl-1-(p-tolylsulfinyl)but-1-en-3-yne
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H22OS
InChI InChI=1S/C25H22OS/c1-21-12-18-25(19-13-21)27(26)20-24(16-14-22-8-4-2-5-9-22)17-15-23-10-6-3-7-11-23/h2-13,18-20H,14,16H2,1H3/b24-20-
InChIKey JOPHUWPVURBTJM-GFMRDNFCSA-N
Molecular Weight 370.510 g/mol
SMILES C(\C(=C/S(c1ccc(cc1)C)=O)CCc1ccccc1)#Cc1ccccc1
SPLASH splash10-00kg-4491000000-cfa5347ccc04df3badcc
Source of Spectrum F-67-3090-38a
Wiley ID 1686349