CID 140211

17267-51-5

Structural Information

Molecular Formula
C3H7N5
SMILES
CNC1=NN=NN1C
InChI
InChI=1S/C3H7N5/c1-4-3-5-6-7-8(3)2/h1-2H3,(H,4,5,7)
InChIKey
FBRRQXJRKCVETE-UHFFFAOYSA-N
Compound name
N,1-dimethyltetrazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

70
Patents

113.070145 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 114.077421 120.5
[M+Na]+ 136.059363 130.6
[M-H]- 112.062869 119.4
[M+NH4]+ 131.103968 139.5
[M+K]+ 152.033303 129.9
[M+H-H2O]+ 96.067405 112.2
[M+HCOO]- 158.068346 143.4
[M+CH3COO]- 172.083996 170.6
[M+Na-2H]- 134.044811 128.9
[M]+ 113.06959642 120.6
[M]- 113.07069358 120.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe