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2,2',2"-(1,3,5-Benzenetriyl)tris[5-(pentylimino)-4,5-dihydro-4-methyl-1,3,4-thiazole]

View entire compound with spectra: 1 MS (GC)

2,2',2"-(1,3,5-Benzenetriyl)tris[5-(pentylimino)-4,5-dihydro-4-methyl-1,3,4-thiazole]
SpectraBase Compound ID I7iUWEKFpJo
InChI InChI=1S/C30H45N9S3/c1-7-10-13-16-31-28-37(4)34-25(40-28)22-19-23(26-35-38(5)29(41-26)32-17-14-11-8-2)21-24(20-22)27-36-39(6)30(42-27)33-18-15-12-9-3/h19-21H,7-18H2,1-6H3/b31-28-,32-29+,33-30+
InChIKey RLUYTSPFRPKFHT-NAEKIHPQSA-N
Mol Weight 627.9 g/mol
Molecular Formula C30H45N9S3
Exact Mass 627.296006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5HErxc5ZABD
Name 2,2',2"-(1,3,5-Benzenetriyl)tris[5-(pentylimino)-4,5-dihydro-4-methyl-1,3,4-thiazole]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H45N9S3
InChI InChI=1S/C30H45N9S3/c1-7-10-13-16-31-28-37(4)34-25(40-28)22-19-23(26-35-38(5)29(41-26)32-17-14-11-8-2)21-24(20-22)27-36-39(6)30(42-27)33-18-15-12-9-3/h19-21H,7-18H2,1-6H3/b31-28-,32-29+,33-30+
InChIKey RLUYTSPFRPKFHT-NAEKIHPQSA-N
Molecular Weight 627.933 g/mol
SMILES C=1(S\C(N(N1)C)=N\CCCCC)c1cc(C=2S\C(=N\CCCCC)N(N2)C)cc(C=2S\C(=N/CCCCC)N(N2)C)c1
SPLASH splash10-00or-1900000000-75241c08a3e5de5b347d
Source of Spectrum H1-36-1275-10
Synonyms 2,2',2''-(1,3,5-Benzenetriyl)tris[5-(pentylimino)-4,5-dihydro-4-methyl-1,3,4-thiazole]
Wiley ID 755360