CID 323221

1-tert-butyltetrazol-5-amine

Structural Information

Molecular Formula
C5H11N5
SMILES
CC(C)(C)N1C(=NN=N1)N
InChI
InChI=1S/C5H11N5/c1-5(2,3)10-4(6)7-8-9-10/h1-3H3,(H2,6,7,9)
InChIKey
FJBIEXNUZHJZSK-UHFFFAOYSA-N
Compound name
1-tert-butyltetrazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

141.10144 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.10872 131.7
[M+Na]+ 164.09066 141.5
[M-H]- 140.09416 130.3
[M+NH4]+ 159.13526 149.7
[M+K]+ 180.06460 140.4
[M+H-H2O]+ 124.09870 124.0
[M+HCOO]- 186.09964 151.8
[M+CH3COO]- 200.11529 175.6
[M+Na-2H]- 162.07611 138.7
[M]+ 141.10089 131.0
[M]- 141.10199 131.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.