CID 55280383

Azetidine-1-sulfonyl chloride

Structural Information

Molecular Formula
C3H6ClNO2S
SMILES
C1CN(C1)S(=O)(=O)Cl
InChI
InChI=1S/C3H6ClNO2S/c4-8(6,7)5-2-1-3-5/h1-3H2
InChIKey
OPHFRFOWQURJRP-UHFFFAOYSA-N
Compound name
azetidine-1-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

82
Patents

154.98077 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.988046 117.3
[M+Na]+ 177.969988 125.1
[M-H]- 153.973494 119.7
[M+NH4]+ 173.014593 131.7
[M+K]+ 193.943928 125.8
[M+H-H2O]+ 137.978030 107.7
[M+HCOO]- 199.978971 128.7
[M+CH3COO]- 213.994621 172.8
[M+Na-2H]- 175.955436 122.6
[M]+ 154.98022142 128.2
[M]- 154.98131858 128.2
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