CID 223446

1-butyl-1h-tetrazol-5-amine

Structural Information

Molecular Formula

C₅H₁₁N₅

SMILES

CCCCN1C(=NN=N1)N

InChI

InChI=1S/C5H11N5/c1-2-3-4-10-5(6)7-8-9-10/h2-4H2,1H3,(H2,6,7,9)

InChIKey

DAFSTKDZKAGKGV-UHFFFAOYSA-N

Compound name

1-butyltetrazol-5-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 34
Patents: 141.10144 Da
Monoisotopic Mass: 0.4
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]+	142.10872	128.7
[M+Na]+	164.09066	139.2
[M+NH4]+	159.13526	135.2
[M+K]+	180.06460	136.3
[M-H]-	140.09416	127.9
[M+Na-2H]-	162.07611	133.8
[M]+	141.10089	129.6
[M]-	141.10199	129.6

Literature stripe

literature stripe

Patent stripe

patents stripe