CID 3032953

38238-24-3

Structural Information

Molecular Formula
C4H9NS
SMILES
C1C[C@H]([C@H]1N)S
InChI
InChI=1S/C4H9NS/c5-3-1-2-4(3)6/h3-4,6H,1-2,5H2/t3-,4+/m0/s1
InChIKey
ZIGBHZKAJIZAGA-IUYQGCFVSA-N
Compound name
(1R,2S)-2-aminocyclobutane-1-thiol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

103.04557 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 104.05285 114.5
[M+Na]+ 126.03479 120.3
[M-H]- 102.03829 117.8
[M+NH4]+ 121.07939 131.1
[M+K]+ 142.00873 122.2
[M+H-H2O]+ 86.042830 103.9
[M+HCOO]- 148.04377 131.9
[M+CH3COO]- 162.05942 171.9
[M+Na-2H]- 124.02024 117.3
[M]+ 103.04502 121.3
[M]- 103.04612 121.3
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.