CID 54593115

1-(1h-1,2,3,4-tetrazol-5-yl)cyclobutan-1-amine hydrochloride

Structural Information

Molecular Formula
C5H9N5
SMILES
C1CC(C1)(C2=NNN=N2)N
InChI
InChI=1S/C5H9N5/c6-5(2-1-3-5)4-7-9-10-8-4/h1-3,6H2,(H,7,8,9,10)
InChIKey
YTEANTQAPNHFOV-UHFFFAOYSA-N
Compound name
1-(2H-tetrazol-5-yl)cyclobutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

139.0858 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.09308 128.2
[M+Na]+ 162.07502 135.1
[M-H]- 138.07852 128.0
[M+NH4]+ 157.11962 140.2
[M+K]+ 178.04896 135.9
[M+H-H2O]+ 122.08306 115.0
[M+HCOO]- 184.08400 146.7
[M+CH3COO]- 198.09965 173.7
[M+Na-2H]- 160.06047 135.1
[M]+ 139.08525 132.0
[M]- 139.08635 132.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe