CID 46703629

3-(1h-1,2,3,4-tetrazol-5-yl)azetidin-3-ol hydrochloride

Structural Information

Molecular Formula
C4H7N5O
SMILES
C1C(CN1)(C2=NNN=N2)O
InChI
InChI=1S/C4H7N5O/c10-4(1-5-2-4)3-6-8-9-7-3/h5,10H,1-2H2,(H,6,7,8,9)
InChIKey
ZOVOOPMAZDPUGR-UHFFFAOYSA-N
Compound name
3-(2H-tetrazol-5-yl)azetidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

141.06506 Da
Monoisotopic Mass

-2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.072336 129.4
[M+Na]+ 164.054278 136.6
[M-H]- 140.057784 125.8
[M+NH4]+ 159.098883 139.1
[M+K]+ 180.028218 136.6
[M+H-H2O]+ 124.062320 116.5
[M+HCOO]- 186.063261 143.7
[M+CH3COO]- 200.078911 139.8
[M+Na-2H]- 162.039726 136.1
[M]+ 141.06451142 132.7
[M]- 141.06560858 132.7
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

No patent data available for this compound.