CID 10080756

3-(2-methyl-2h-1,2,3,4-tetrazol-5-yl)piperidine hydrochloride

Structural Information

Molecular Formula
C7H13N5
SMILES
CN1N=C(N=N1)C2CCCNC2
InChI
InChI=1S/C7H13N5/c1-12-10-7(9-11-12)6-3-2-4-8-5-6/h6,8H,2-5H2,1H3
InChIKey
VLRAZBUJGZMMTL-UHFFFAOYSA-N
Compound name
3-(2-methyltetrazol-5-yl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

9
Patents

167.1171 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.12438 139.1
[M+Na]+ 190.10632 146.2
[M-H]- 166.10982 137.1
[M+NH4]+ 185.15092 153.4
[M+K]+ 206.08026 143.2
[M+H-H2O]+ 150.11436 128.9
[M+HCOO]- 212.11530 153.9
[M+CH3COO]- 226.13095 149.5
[M+Na-2H]- 188.09177 143.3
[M]+ 167.11655 133.2
[M]- 167.11765 133.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe