CID 75480501

1-cyclopentanecarbonylazetidine-3-sulfonyl chloride

Structural Information

Molecular Formula
C9H14ClNO3S
SMILES
C1CCC(C1)C(=O)N2CC(C2)S(=O)(=O)Cl
InChI
InChI=1S/C9H14ClNO3S/c10-15(13,14)8-5-11(6-8)9(12)7-3-1-2-4-7/h7-8H,1-6H2
InChIKey
YQHUVWISAHUGSF-UHFFFAOYSA-N
Compound name
1-(cyclopentanecarbonyl)azetidine-3-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

251.0383 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 252.04558 145.7
[M+Na]+ 274.02752 150.9
[M-H]- 250.03102 150.4
[M+NH4]+ 269.07212 157.7
[M+K]+ 290.00146 150.8
[M+H-H2O]+ 234.03556 135.3
[M+HCOO]- 296.03650 154.1
[M+CH3COO]- 310.05215 189.0
[M+Na-2H]- 272.01297 145.0
[M]+ 251.03775 155.0
[M]- 251.03885 155.0
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

No patent data available for this compound.