CID 213569

Brn 0567475

Structural Information

Molecular Formula
C22H27N5
SMILES
CC(C)C1=NC(=NC(=N1)NCCC2=CC=CC=C2)NCCC3=CC=CC=C3
InChI
InChI=1S/C22H27N5/c1-17(2)20-25-21(23-15-13-18-9-5-3-6-10-18)27-22(26-20)24-16-14-19-11-7-4-8-12-19/h3-12,17H,13-16H2,1-2H3,(H2,23,24,25,26,27)
InChIKey
HKIHGLXLDGYVSM-UHFFFAOYSA-N
Compound name
2-N,4-N-bis(2-phenylethyl)-6-propan-2-yl-1,3,5-triazine-2,4-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

361.22665 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 362.23393 191.5
[M+Na]+ 384.21587 205.9
[M+NH4]+ 379.26047 198.2
[M+K]+ 400.18981 196.6
[M-H]- 360.21937 198.0
[M+Na-2H]- 382.20132 202.3
[M]+ 361.22610 195.4
[M]- 361.22720 195.4
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.