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1,2-bis[4'-(1'',2'',3''-Thiadiazol-4"-yl)phenoxy]dodecane
SpectraBase Compound ID JOXhJZiy2vL
InChI InChI=1S/C28H34N4O2S2/c1-2-3-4-5-6-7-8-9-10-26(34-25-17-13-23(14-18-25)28-21-36-32-30-28)19-33-24-15-11-22(12-16-24)27-20-35-31-29-27/h11-18,20-21,26H,2-10,19H2,1H3
InChIKey RKHXYQUXPZHPAB-UHFFFAOYSA-N
Mol Weight 522.7 g/mol
Molecular Formula C28H34N4O2S2
Exact Mass 522.212319 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2ybN3RFywud
Name 1,2-bis[4'-(1'',2'',3''-Thiadiazol-4"-yl)phenoxy]dodecane
Alternate Name(s) 1,2-bis[4'-(1'',2'',3''-thiadiazol-4''-yl)phenoxy]dodecane 4-{4-[(1-{[4-(1,2,3-thiadiazol-4-yl)phenoxy]methyl}undecyl)oxy]phenyl}-1,2,3-thiadiazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H34N4O2S2
InChI InChI=1S/C28H34N4O2S2/c1-2-3-4-5-6-7-8-9-10-26(34-25-17-13-23(14-18-25)28-21-36-32-30-28)19-33-24-15-11-22(12-16-24)27-20-35-31-29-27/h11-18,20-21,26H,2-10,19H2,1H3
InChIKey RKHXYQUXPZHPAB-UHFFFAOYSA-N
Molecular Weight 522.726 g/mol
SMILES c1(nnsc1)-c1ccc(OC(COc2ccc(-c3nnsc3)cc2)CCCCCCCCCC)cc1
SPLASH splash10-0zfr-8900200000-2db68a7cc2c4ff927894
Source of Spectrum Y-34-610-3
Wiley ID 1402240