CID 23279255

5-azido-2h-tetrazole

Structural Information

Molecular Formula
CHN7
SMILES
C1(=NNN=N1)N=[N+]=[N-]
InChI
InChI=1S/CHN7/c2-6-3-1-4-7-8-5-1/h(H,4,5,7,8)
InChIKey
KDAOLWKYSLHLSZ-UHFFFAOYSA-N
Compound name
5-azido-2H-tetrazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

108
Patents

111.02934 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 112.03662 113.0
[M+Na]+ 134.01856 121.8
[M-H]- 110.02206 113.4
[M+NH4]+ 129.06316 131.3
[M+K]+ 149.99250 116.8
[M+H-H2O]+ 94.026600 108.5
[M+HCOO]- 156.02754 141.0
[M+CH3COO]- 170.04319 165.9
[M+Na-2H]- 132.00401 127.3
[M]+ 111.02879 108.5
[M]- 111.02989 108.5
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