CID 54595194

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

Structural Information

Molecular Formula
C6H13N5
SMILES
CCC(CC)(C1=NNN=N1)N
InChI
InChI=1S/C6H13N5/c1-3-6(7,4-2)5-8-10-11-9-5/h3-4,7H2,1-2H3,(H,8,9,10,11)
InChIKey
XXOGQGNIIXHJTD-UHFFFAOYSA-N
Compound name
3-(2H-tetrazol-5-yl)pentan-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.1171 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.12438 136.1
[M+Na]+ 178.10632 143.9
[M-H]- 154.10982 132.7
[M+NH4]+ 173.15092 152.3
[M+K]+ 194.08026 141.7
[M+H-H2O]+ 138.11436 128.0
[M+HCOO]- 200.11530 154.4
[M+CH3COO]- 214.13095 175.5
[M+Na-2H]- 176.09177 142.8
[M]+ 155.11655 133.5
[M]- 155.11765 133.5
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.