CID 75480497

1-cyclopentanecarbonylpiperidine-3-sulfonyl chloride

Structural Information

Molecular Formula
C11H18ClNO3S
SMILES
C1CCC(C1)C(=O)N2CCCC(C2)S(=O)(=O)Cl
InChI
InChI=1S/C11H18ClNO3S/c12-17(15,16)10-6-3-7-13(8-10)11(14)9-4-1-2-5-9/h9-10H,1-8H2
InChIKey
UFDFTTPRFQZBEB-UHFFFAOYSA-N
Compound name
1-(cyclopentanecarbonyl)piperidine-3-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

279.06958 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 280.07686 163.3
[M+Na]+ 302.05880 168.6
[M-H]- 278.06230 167.8
[M+NH4]+ 297.10340 180.6
[M+K]+ 318.03274 165.0
[M+H-H2O]+ 262.06684 157.8
[M+HCOO]- 324.06778 169.9
[M+CH3COO]- 338.08343 190.3
[M+Na-2H]- 300.04425 161.3
[M]+ 279.06903 161.3
[M]- 279.07013 161.3
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.