CID 255685

4-((3,4-dichlorophenyl)sulfonyl)morpholine

Structural Information

Molecular Formula
C10H11Cl2NO3S
SMILES
C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)Cl)Cl
InChI
InChI=1S/C10H11Cl2NO3S/c11-9-2-1-8(7-10(9)12)17(14,15)13-3-5-16-6-4-13/h1-2,7H,3-6H2
InChIKey
SRRDVOXFXBPTBH-UHFFFAOYSA-N
Compound name
4-(3,4-dichlorophenyl)sulfonylmorpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

294.98367 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.99095 157.6
[M+Na]+ 317.97289 166.4
[M-H]- 293.97639 163.3
[M+NH4]+ 313.01749 172.1
[M+K]+ 333.94683 162.4
[M+H-H2O]+ 277.98093 152.2
[M+HCOO]- 339.98187 161.7
[M+CH3COO]- 353.99752 193.1
[M+Na-2H]- 315.95834 160.9
[M]+ 294.98312 160.4
[M]- 294.98422 160.4
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