CID 59261062

2089255-74-1

Structural Information

Molecular Formula

C₇H₁₃N₅

SMILES

C1CNCCC1CC2=NNN=N2

InChI

InChI=1S/C7H13N5/c1-3-8-4-2-6(1)5-7-9-11-12-10-7/h6,8H,1-5H2,(H,9,10,11,12)

InChIKey

JBTYRLGOSVXXRJ-UHFFFAOYSA-N

Compound name

4-(2H-tetrazol-5-ylmethyl)piperidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 6
Patents: 167.1171 Da
Monoisotopic Mass: 0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	168.12438	138.1
[M+Na]+	190.10632	148.4
[M+NH4]+	185.15092	144.4
[M+K]+	206.08026	145.1
[M-H]-	166.10982	137.5
[M+Na-2H]-	188.09177	143.5
[M]+	167.11655	138.9
[M]-	167.11765	138.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe