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

101
Patents

154.98077 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.98805 117.3
[M+Na]+ 177.96999 125.1
[M-H]- 153.97349 119.7
[M+NH4]+ 173.01459 131.7
[M+K]+ 193.94393 125.8
[M+H-H2O]+ 137.97803 107.7
[M+HCOO]- 199.97897 128.7
[M+CH3COO]- 213.99462 172.8
[M+Na-2H]- 175.95544 122.6
[M]+ 154.98022 128.2
[M]- 154.98132 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