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4-Methyl-N-(3-(phenylethynyl)cyclopent-2-en-1-yl)-N-(p-tolylethynyl)benzenesulfonamide
SpectraBase Compound ID 7D8MXVuSNf7
InChI InChI=1S/C29H25NO2S/c1-23-8-12-26(13-9-23)20-21-30(33(31,32)29-18-10-24(2)11-19-29)28-17-16-27(22-28)15-14-25-6-4-3-5-7-25/h3-13,18-19,22,28H,16-17H2,1-2H3
InChIKey ODSFYIXPSHKTJC-UHFFFAOYSA-N
Mol Weight 451.58 g/mol
Molecular Formula C29H25NO2S
Exact Mass 451.1606 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JrqP26ei8bE
Name 4-Methyl-N-(3-(phenylethynyl)cyclopent-2-en-1-yl)-N-(p-tolylethynyl)benzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H25NO2S
InChI InChI=1S/C29H25NO2S/c1-23-8-12-26(13-9-23)20-21-30(33(31,32)29-18-10-24(2)11-19-29)28-17-16-27(22-28)15-14-25-6-4-3-5-7-25/h3-13,18-19,22,28H,16-17H2,1-2H3
InChIKey ODSFYIXPSHKTJC-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201801469
Molecular Weight 451.584 g/mol
SMILES c1(S(N(C2CCC(C#Cc3ccccc3)=C2)C#Cc2ccc(C)cc2)(=O)=O)ccc(C)cc1
SPLASH splash10-015a-0940000000-37827b73c6f02c61d158
Source of Spectrum ASC-361-SM27-3b
Wiley ID 1813976