CID 213567

S-triazine, 4,6-bis(cyclohexylamino)-2-butyl-

Structural Information

Molecular Formula
C19H33N5
SMILES
CCCCC1=NC(=NC(=N1)NC2CCCCC2)NC3CCCCC3
InChI
InChI=1S/C19H33N5/c1-2-3-14-17-22-18(20-15-10-6-4-7-11-15)24-19(23-17)21-16-12-8-5-9-13-16/h15-16H,2-14H2,1H3,(H2,20,21,22,23,24)
InChIKey
UQPINPHOXJUEBF-UHFFFAOYSA-N
Compound name
6-butyl-2-N,4-N-dicyclohexyl-1,3,5-triazine-2,4-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

331.2736 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 332.28088 185.6
[M+Na]+ 354.26282 195.3
[M+NH4]+ 349.30742 192.6
[M+K]+ 370.23676 187.2
[M-H]- 330.26632 191.1
[M+Na-2H]- 352.24827 192.2
[M]+ 331.27305 188.2
[M]- 331.27415 188.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.