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(R,E)-N-(2-benzylidene-1-(2-chlorophenyl)-4-phenylbut-3-ynyl)-4-methylbenzene-sulfonamide
SpectraBase Compound ID 7CRI16ER2kZ
InChI InChI=1S/C30H24ClNO2S/c1-23-16-20-27(21-17-23)35(33,34)32-30(28-14-8-9-15-29(28)31)26(22-25-12-6-3-7-13-25)19-18-24-10-4-2-5-11-24/h2-17,20-22,30,32H,1H3/b26-22+/t30-/m1/s1
InChIKey WYPQZEBJEGGEOF-OQEOGVJXSA-N
Mol Weight 498.04 g/mol
Molecular Formula C30H24ClNO2S
Exact Mass 497.121628 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JA5WezV1DLi
Name (R,E)-N-(2-benzylidene-1-(2-chlorophenyl)-4-phenylbut-3-ynyl)-4-methylbenzene-sulfonamide
Alternate Name(s) (R,E)-N-(2-benzylidene-1-(2-chlorophenyl)-4-phenylbut-3-yn-1-yl)-4-methylbenzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H24ClNO2S
InChI InChI=1S/C30H24ClNO2S/c1-23-16-20-27(21-17-23)35(33,34)32-30(28-14-8-9-15-29(28)31)26(22-25-12-6-3-7-13-25)19-18-24-10-4-2-5-11-24/h2-17,20-22,30,32H,1H3/b26-22+/t30-/m1/s1
InChIKey WYPQZEBJEGGEOF-OQEOGVJXSA-N
Literature Reference DOI 10.1002/adsc.200900219
Molecular Weight 498.040 g/mol
SMILES N([C@@](c1ccccc1Cl)(\C(C#Cc1ccccc1)=C\c1ccccc1)[H])S(=O)(c1ccc(C)cc1)=O
SPLASH splash10-0006-9531000000-dae74ffd4b9d8386a40a
Source of Spectrum ASC-351-1512/SM5-7e
Wiley ID 1763257