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5-(4-(hexyloxy)phenyl)-N-(pyridin-4-ylmethylene)-1,3,4-thiadiazol-2-amine

View entire compound with spectra: 1 MS (GC)

5-(4-(hexyloxy)phenyl)-N-(pyridin-4-ylmethylene)-1,3,4-thiadiazol-2-amine
SpectraBase Compound ID 5Sh6fTskPSN
InChI InChI=1S/C20H22N4OS/c1-2-3-4-5-14-25-18-8-6-17(7-9-18)19-23-24-20(26-19)22-15-16-10-12-21-13-11-16/h6-13,15H,2-5,14H2,1H3/b22-15+
InChIKey USJHNEDNSBNVCG-PXLXIMEGSA-N
Mol Weight 366.48 g/mol
Molecular Formula C20H22N4OS
Exact Mass 366.151433 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ksg6uZkdl63
Name 5-(4-(hexyloxy)phenyl)-N-(pyridin-4-ylmethylene)-1,3,4-thiadiazol-2-amine
Alternate Name(s) (E)-5-(4-(hexyloxy)phenyl)-N-(pyridin-4-ylmethylene)-1,3,4-thiadiazol-2-amine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22N4OS
InChI InChI=1S/C20H22N4OS/c1-2-3-4-5-14-25-18-8-6-17(7-9-18)19-23-24-20(26-19)22-15-16-10-12-21-13-11-16/h6-13,15H,2-5,14H2,1H3/b22-15+
InChIKey USJHNEDNSBNVCG-PXLXIMEGSA-N
Literature Reference DOI 10.1002/cjoc.20010190912
Molecular Weight 366.483 g/mol
SMILES c1(nnc(s1)\N=C\c1ccncc1)-c1ccc(cc1)OCCCCCC
SPLASH splash10-014i-1039000000-69408f13868e7159caa9
Source of Spectrum CJC-19-872-Ic
Wiley ID 1773610