CID 212661

6-cyclopropyl-1,3,5-triazine-2,4-diamine

Structural Information

Molecular Formula
C6H9N5
SMILES
C1CC1C2=NC(=NC(=N2)N)N
InChI
InChI=1S/C6H9N5/c7-5-9-4(3-1-2-3)10-6(8)11-5/h3H,1-2H2,(H4,7,8,9,10,11)
InChIKey
RUQYQUHBSPKBEU-UHFFFAOYSA-N
Compound name
6-cyclopropyl-1,3,5-triazine-2,4-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

32
Patents

151.0858 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.09308 138.0
[M+Na]+ 174.07502 149.1
[M-H]- 150.07852 141.4
[M+NH4]+ 169.11962 149.8
[M+K]+ 190.04896 144.3
[M+H-H2O]+ 134.08306 129.7
[M+HCOO]- 196.08400 161.2
[M+CH3COO]- 210.09965 150.3
[M+Na-2H]- 172.06047 144.9
[M]+ 151.08525 136.9
[M]- 151.08635 136.9
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

patents stripe