3-[Chloro(p-tolylsulfinyl)methyl]-3-(2-phenylethyl)-5-phenylpentanenitrile

SpectraBase Compound ID	Ho1rxH9dg1O
InChI	InChI=1S/C27H28ClNOS/c1-22-12-14-25(15-13-22)31(30)26(28)27(20-21-29,18-16-23-8-4-2-5-9-23)19-17-24-10-6-3-7-11-24/h2-15,26H,16-20H2,1H3
InChIKey	OXLOZTGCEJBCFA-UHFFFAOYSA-N Google Search
Mol Weight	450.04 g/mol
Molecular Formula	C27H28ClNOS
Exact Mass	449.158013 g/mol

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SpectraBase Spectrum ID	AlwQ9c8QUGu
Name	3-[Chloro(p-tolylsulfinyl)methyl]-3-(2-phenylethyl)-5-phenylpentanenitrile
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C27H28ClNOS
InChI	InChI=1S/C27H28ClNOS/c1-22-12-14-25(15-13-22)31(30)26(28)27(20-21-29,18-16-23-8-4-2-5-9-23)19-17-24-10-6-3-7-11-24/h2-15,26H,16-20H2,1H3
InChIKey	OXLOZTGCEJBCFA-UHFFFAOYSA-N
Molecular Weight	450.040 g/mol
SMILES	C(S(c1ccc(cc1)C)=O)(C(CCc1ccccc1)(CCc1ccccc1)CC#N)Cl
SPLASH	splash10-0006-8900100000-3a409e7182b85e270f60
Source of Spectrum	F-68-2488-17at
Wiley ID	1708113