CID 186839

69844-52-6

Structural Information

Molecular Formula
C6H11N5
SMILES
CC(C)NC1=NC=NC(=N1)N
InChI
InChI=1S/C6H11N5/c1-4(2)10-6-9-3-8-5(7)11-6/h3-4H,1-2H3,(H3,7,8,9,10,11)
InChIKey
WBEKRMVYCWRRDJ-UHFFFAOYSA-N
Compound name
2-N-propan-2-yl-1,3,5-triazine-2,4-diamine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

35
Patents

153.10144 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.10872 133.0
[M+Na]+ 176.09066 140.9
[M-H]- 152.09416 132.6
[M+NH4]+ 171.13526 149.4
[M+K]+ 192.06460 139.1
[M+H-H2O]+ 136.09870 124.8
[M+HCOO]- 198.09964 155.1
[M+CH3COO]- 212.11529 181.6
[M+Na-2H]- 174.07611 140.8
[M]+ 153.10089 130.7
[M]- 153.10199 130.7
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.