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N-but-2-ynyl-4-methyl-N-(8-phenylocta-2,7-diynyl)benzenesulfonamide
SpectraBase Compound ID Nvzs0TBfrs
InChI InChI=1S/C25H25NO2S/c1-3-4-21-26(29(27,28)25-19-17-23(2)18-20-25)22-13-8-6-5-7-10-14-24-15-11-9-12-16-24/h9,11-12,15-20H,5-7,21-22H2,1-2H3
InChIKey DEIHMLHOTGORDQ-UHFFFAOYSA-N
Mol Weight 403.54 g/mol
Molecular Formula C25H25NO2S
Exact Mass 403.1606 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F3r4f5p41B6
Name N-but-2-ynyl-4-methyl-N-(8-phenylocta-2,7-diynyl)benzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H25NO2S
InChI InChI=1S/C25H25NO2S/c1-3-4-21-26(29(27,28)25-19-17-23(2)18-20-25)22-13-8-6-5-7-10-14-24-15-11-9-12-16-24/h9,11-12,15-20H,5-7,21-22H2,1-2H3
InChIKey DEIHMLHOTGORDQ-UHFFFAOYSA-N
Molecular Weight 403.540 g/mol
SMILES c1(S(N(CC#CCCCC#Cc2ccccc2)CC#CC)(=O)=O)ccc(cc1)C
SPLASH splash10-00kf-9640000000-dd64d3516b2517c32462
Source of Spectrum J-63-8607-5
Wiley ID 1370942