CID 82418442

2-(1,2,4-triazin-3-yl)propan-2-amine hydrochloride

Structural Information

Molecular Formula
C6H10N4
SMILES
CC(C)(C1=NC=CN=N1)N
InChI
InChI=1S/C6H10N4/c1-6(2,7)5-8-3-4-9-10-5/h3-4H,7H2,1-2H3
InChIKey
PJQZKUGLQCOABI-UHFFFAOYSA-N
Compound name
2-(1,2,4-triazin-3-yl)propan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

138.09055 Da
Monoisotopic Mass

-1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 139.09783 129.9
[M+Na]+ 161.07977 138.3
[M-H]- 137.08327 129.2
[M+NH4]+ 156.12437 147.1
[M+K]+ 177.05371 136.6
[M+H-H2O]+ 121.08781 122.4
[M+HCOO]- 183.08875 150.2
[M+CH3COO]- 197.10440 175.0
[M+Na-2H]- 159.06522 139.7
[M]+ 138.09000 127.9
[M]- 138.09110 127.9
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.