CID 138677

5-amino-2-methyl-2h-tetrazole

Structural Information

Molecular Formula

C₂H₅N₅

SMILES

CN1N=C(N=N1)N

InChI

InChI=1S/C2H5N5/c1-7-5-2(3)4-6-7/h1H3,(H2,3,5)

InChIKey

AZUKLCJYWVMPML-UHFFFAOYSA-N

Compound name

2-methyltetrazol-5-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 4
References: 507
Patents: 99.0545 Da
Monoisotopic Mass: -0.2
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]+	100.06178	115.5
[M+Na]+	122.04372	126.6
[M+NH4]+	117.08832	122.4
[M+K]+	138.01766	124.4
[M-H]-	98.047224	114.8
[M+Na-2H]-	120.02917	121.3
[M]+	99.053951	116.5
[M]-	99.055049	116.5

Literature stripe

literature stripe

Patent stripe

patents stripe