CID 142993

N-methyl-1h-1,2,3,4-tetrazol-5-amine

Structural Information

Molecular Formula
C2H5N5
SMILES
CNC1=NNN=N1
InChI
InChI=1S/C2H5N5/c1-3-2-4-6-7-5-2/h1H3,(H2,3,4,5,6,7)
InChIKey
LQICKCWPFRQEFI-UHFFFAOYSA-N
Compound name
N-methyl-2H-tetrazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

239
Patents

99.0545 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 100.06178 116.4
[M+Na]+ 122.04372 125.5
[M-H]- 98.047224 113.7
[M+NH4]+ 117.08832 134.9
[M+K]+ 138.01766 124.3
[M+H-H2O]+ 82.051760 108.2
[M+HCOO]- 144.05270 138.1
[M+CH3COO]- 158.06835 163.9
[M+Na-2H]- 120.02917 125.5
[M]+ 99.053951 113.8
[M]- 99.055049 113.8
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