CID 126972725

3-amino-n-(2-methyl-2h-1,2,3,4-tetrazol-5-yl)propanamide hydrochloride

Structural Information

Molecular Formula
C5H10N6O
SMILES
CN1N=C(N=N1)NC(=O)CCN
InChI
InChI=1S/C5H10N6O/c1-11-9-5(8-10-11)7-4(12)2-3-6/h2-3,6H2,1H3,(H,7,9,12)
InChIKey
KVUJFNLIVJPZTJ-UHFFFAOYSA-N
Compound name
3-amino-N-(2-methyltetrazol-5-yl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

170.09161 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.098886 135.3
[M+Na]+ 193.080828 143.7
[M-H]- 169.084334 133.8
[M+NH4]+ 188.125433 151.4
[M+K]+ 209.054768 142.4
[M+H-H2O]+ 153.088870 126.4
[M+HCOO]- 215.089811 157.6
[M+CH3COO]- 229.105461 182.3
[M+Na-2H]- 191.066276 141.1
[M]+ 170.09106142 134.5
[M]- 170.09215858 134.5
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.