CID 2160995

4-[3-(chloromethyl)benzenesulfonyl]morpholine

Structural Information

Molecular Formula
C11H14ClNO3S
SMILES
C1COCCN1S(=O)(=O)C2=CC=CC(=C2)CCl
InChI
InChI=1S/C11H14ClNO3S/c12-9-10-2-1-3-11(8-10)17(14,15)13-4-6-16-7-5-13/h1-3,8H,4-7,9H2
InChIKey
GGZAEHHVKQQWFO-UHFFFAOYSA-N
Compound name
4-[3-(chloromethyl)phenyl]sulfonylmorpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

275.0383 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.04558 157.7
[M+Na]+ 298.02752 170.5
[M+NH4]+ 293.07212 165.7
[M+K]+ 314.00146 162.5
[M-H]- 274.03102 161.4
[M+Na-2H]- 296.01297 163.9
[M]+ 275.03775 161.3
[M]- 275.03885 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

patents stripe