CID 138492

5422-44-6

Structural Information

Molecular Formula
C2H5N5
SMILES
CN1C(=NN=N1)N
InChI
InChI=1S/C2H5N5/c1-7-2(3)4-5-6-7/h1H3,(H2,3,4,6)
InChIKey
GTKOKCQMHAGFSM-UHFFFAOYSA-N
Compound name
1-methyltetrazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

1268
Patents

99.0545 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 100.06178 116.3
[M+Na]+ 122.04372 126.8
[M-H]- 98.047224 114.8
[M+NH4]+ 117.08832 135.6
[M+K]+ 138.01766 126.1
[M+H-H2O]+ 82.051760 108.3
[M+HCOO]- 144.05270 138.9
[M+CH3COO]- 158.06835 166.9
[M+Na-2H]- 120.02917 124.2
[M]+ 99.053951 115.0
[M]- 99.055049 115.0
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