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]+ 169.119626 137.7
[M+Na]+ 191.101568 144.4
[M-H]- 167.105074 135.6
[M+NH4]+ 186.146173 151.5
[M+K]+ 207.075508 141.2
[M+H-H2O]+ 151.109610 127.5
[M+HCOO]- 213.110551 153.4
[M+CH3COO]- 227.126201 147.9
[M+Na-2H]- 189.087016 142.3
[M]+ 168.11180142 130.0
[M]- 168.11289858 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

patents stripe