CID 5146781

(1h-1,2,3,4-tetrazol-5-yl)methanamine

Structural Information

Molecular Formula
C2H5N5
SMILES
C(C1=NNN=N1)N
InChI
InChI=1S/C2H5N5/c3-1-2-4-6-7-5-2/h1,3H2,(H,4,5,6,7)
InChIKey
ZHCLIFKUVIFYBY-UHFFFAOYSA-N
Compound name
2H-tetrazol-5-ylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

933
Patents

99.0545 Da
Monoisotopic Mass

-1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 100.06178 116.5
[M+Na]+ 122.04372 125.6
[M-H]- 98.047224 113.3
[M+NH4]+ 117.08832 134.8
[M+K]+ 138.01766 124.1
[M+H-H2O]+ 82.051760 108.4
[M+HCOO]- 144.05270 137.7
[M+CH3COO]- 158.06835 163.2
[M+Na-2H]- 120.02917 124.7
[M]+ 99.053951 113.0
[M]- 99.055049 113.0
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