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Triimidazo[1,5-a:1',5'-c:1'',5''-e][1,3,5]triazine-1,5,9(2H,6H,10H)-trithione, 2,6,10-tricyclohexylhexahydro-3,3,7,7,11,11-hexamethyl-

View entire compound with spectra: 1 MS (GC)

Triimidazo[1,5-a:1',5'-c:1'',5''-e][1,3,5]triazine-1,5,9(2H,6H,10H)-trithione, 2,6,10-tricyclohexylhexahydro-3,3,7,7,11,11-hexamethyl-
SpectraBase Compound ID 8U9mO5fgyLI
InChI InChI=1S/C33H54N6S3/c1-31(2)25-34(28(40)37(31)22-16-10-7-11-17-22)26-32(3,4)39(24-20-14-9-15-21-24)30(42)36(26)27-33(5,6)38(29(41)35(25)27)23-18-12-8-13-19-23/h22-27H,7-21H2,1-6H3
InChIKey PIBNYWKEERFKEP-UHFFFAOYSA-N
Mol Weight 631.0 g/mol
Molecular Formula C33H54N6S3
Exact Mass 630.357209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2rYGH1Zs8xb
Name Triimidazo[1,5-a:1',5'-c:1'',5''-e][1,3,5]triazine-1,5,9(2H,6H,10H)-trithione, 2,6,10-tricyclohexylhexahydro-3,3,7,7,11,11-hexamethyl-
CAS Registry Number 67969-54-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H54N6S3
InChI InChI=1S/C33H54N6S3/c1-31(2)25-34(28(40)37(31)22-16-10-7-11-17-22)26-32(3,4)39(24-20-14-9-15-21-24)30(42)36(26)27-33(5,6)38(29(41)35(25)27)23-18-12-8-13-19-23/h22-27H,7-21H2,1-6H3
InChIKey PIBNYWKEERFKEP-UHFFFAOYSA-N
Molecular Weight 631.017 g/mol
SMILES C12N(C3C(C)(C)N(C(N3C3N1C(=S)N(C3(C)C)C1CCCCC1)=S)C1CCCCC1)C(N(C2(C)C)C1CCCCC1)=S
SPLASH splash10-00ba-9410000000-102d0fd4d5696b4c854d
Source of Spectrum W5-38034-27502-27502
Synonyms 2,6,10-Tricyclohexyl-3,3,7,7,11,11-hexamethylhexahydrotriimidazo[1,5-a:1,5-c:1,5-E][1,3,5]triazine-1,5,9(2H,6H,10H)-trithione
Wiley ID 1412092