CID 54595870

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

Structural Information

Molecular Formula
C5H9N5
SMILES
C1CC1N2C(=NN=N2)CN
InChI
InChI=1S/C5H9N5/c6-3-5-7-8-9-10(5)4-1-2-4/h4H,1-3,6H2
InChIKey
MCNWRJBCZNVPIL-UHFFFAOYSA-N
Compound name
(1-cyclopropyltetrazol-5-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

139.0858 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.093076 138.1
[M+Na]+ 162.075018 149.4
[M-H]- 138.078524 140.2
[M+NH4]+ 157.119623 151.0
[M+K]+ 178.048958 145.3
[M+H-H2O]+ 122.083060 129.1
[M+HCOO]- 184.084001 160.3
[M+CH3COO]- 198.099651 150.4
[M+Na-2H]- 160.060466 143.8
[M]+ 139.08525142 138.8
[M]- 139.08634858 138.8
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.