CID 68311072

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

Structural Information

Molecular Formula
C6H12N6
SMILES
C1CN(CCC1N)C2=NNN=N2
InChI
InChI=1S/C6H12N6/c7-5-1-3-12(4-2-5)6-8-10-11-9-6/h5H,1-4,7H2,(H,8,9,10,11)
InChIKey
VDYWWWKKIRLJPG-UHFFFAOYSA-N
Compound name
1-(2H-tetrazol-5-yl)piperidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

168.11235 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.11963 137.7
[M+Na]+ 191.10157 144.4
[M-H]- 167.10507 135.6
[M+NH4]+ 186.14617 151.5
[M+K]+ 207.07551 141.2
[M+H-H2O]+ 151.10961 127.5
[M+HCOO]- 213.11055 153.4
[M+CH3COO]- 227.12620 147.9
[M+Na-2H]- 189.08702 142.3
[M]+ 168.11180 130.0
[M]- 168.11290 130.0
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.