CID 83872361

2060052-70-0

Structural Information

Molecular Formula
C5H11N5
SMILES
CN(C)C1=NNC(=N1)CN
InChI
InChI=1S/C5H11N5/c1-10(2)5-7-4(3-6)8-9-5/h3,6H2,1-2H3,(H,7,8,9)
InChIKey
DOJPFFJADLTHPX-UHFFFAOYSA-N
Compound name
5-(aminomethyl)-N,N-dimethyl-1H-1,2,4-triazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

141.10144 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.10872 129.1
[M+Na]+ 164.09066 137.1
[M-H]- 140.09416 128.8
[M+NH4]+ 159.13526 147.7
[M+K]+ 180.06460 136.2
[M+H-H2O]+ 124.09870 120.9
[M+HCOO]- 186.09964 152.2
[M+CH3COO]- 200.11529 178.7
[M+Na-2H]- 162.07611 134.8
[M]+ 141.10089 127.0
[M]- 141.10199 127.0
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.