CID 213565

26740-89-6

Structural Information

Molecular Formula
C20H23N5
SMILES
CC1=NC(=NC(=N1)NCCC2=CC=CC=C2)NCCC3=CC=CC=C3
InChI
InChI=1S/C20H23N5/c1-16-23-19(21-14-12-17-8-4-2-5-9-17)25-20(24-16)22-15-13-18-10-6-3-7-11-18/h2-11H,12-15H2,1H3,(H2,21,22,23,24,25)
InChIKey
OCFYUVOANWPXRJ-UHFFFAOYSA-N
Compound name
6-methyl-2-N,4-N-bis(2-phenylethyl)-1,3,5-triazine-2,4-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

333.19534 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 334.20262 180.7
[M+Na]+ 356.18456 186.1
[M-H]- 332.18806 185.6
[M+NH4]+ 351.22916 189.1
[M+K]+ 372.15850 178.9
[M+H-H2O]+ 316.19260 168.3
[M+HCOO]- 378.19354 202.2
[M+CH3COO]- 392.20919 189.5
[M+Na-2H]- 354.17001 188.2
[M]+ 333.19479 179.9
[M]- 333.19589 179.9
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.