CID 83826320

2825012-44-8

Structural Information

Molecular Formula

C₆H₇N₅

SMILES

C1=CN2C(=NN=N2)C=C1CN

InChI

InChI=1S/C6H7N5/c7-4-5-1-2-11-6(3-5)8-9-10-11/h1-3H,4,7H2

InChIKey

JHGTXNFMYLJQBT-UHFFFAOYSA-N

Compound name

tetrazolo[1,5-a]pyridin-7-ylmethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 149.07014 Da
Monoisotopic Mass: -1.2
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]+	150.077416	127.2
[M+Na]+	172.059358	138.6
[M-H]-	148.062864	126.8
[M+NH4]+	167.103963	145.7
[M+K]+	188.033298	135.5
[M+H-H2O]+	132.067400	118.8
[M+HCOO]-	194.068341	150.0
[M+CH3COO]-	208.083991	140.9
[M+Na-2H]-	170.044806	137.2
[M]+	149.06959142	127.9
[M]-	149.07068858	127.9

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.