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1-(3,5-ditert-butylphenyl)-[1,2,4]triazolo[3,4-b][1,3]benzothiazole-6,7-dicarbonitrile
SpectraBase Compound ID Lo7yXs539nJ
InChI InChI=1S/C24H23N5S/c1-23(2,3)17-7-14(8-18(11-17)24(4,5)6)21-27-28-22-29(21)19-9-15(12-25)16(13-26)10-20(19)30-22/h7-11H,1-6H3
InChIKey KULQPGOWKDXGJF-UHFFFAOYSA-N
Mol Weight 413.54 g/mol
Molecular Formula C24H23N5S
Exact Mass 413.167417 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3iPC4lOB2e
Name 1-(3,5-ditert-butylphenyl)-[1,2,4]triazolo[3,4-b][1,3]benzothiazole-6,7-dicarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H23N5S
InChI InChI=1S/C24H23N5S/c1-23(2,3)17-7-14(8-18(11-17)24(4,5)6)21-27-28-22-29(21)19-9-15(12-25)16(13-26)10-20(19)30-22/h7-11H,1-6H3
InChIKey KULQPGOWKDXGJF-UHFFFAOYSA-N
Molecular Weight 413.543 g/mol
SMILES CC(c1cc(-c2[n]-3c(nn2)Sc2c3cc(c(C#N)c2)C#N)cc(C(C)(C)C)c1)(C)C
SPLASH splash10-0002-7809200000-c750a1c1d74de1abe3d6
Wiley ID 1442292