CID 43350799

2-(4-methanesulfonylphenyl)morpholine hydrochloride

Structural Information

Molecular Formula
C11H15NO3S
SMILES
CS(=O)(=O)C1=CC=C(C=C1)C2CNCCO2
InChI
InChI=1S/C11H15NO3S/c1-16(13,14)10-4-2-9(3-5-10)11-8-12-6-7-15-11/h2-5,11-12H,6-8H2,1H3
InChIKey
XTWWKBPFMXUQJP-UHFFFAOYSA-N
Compound name
2-(4-methylsulfonylphenyl)morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

241.07727 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.08455 151.0
[M+Na]+ 264.06649 157.4
[M-H]- 240.06999 155.3
[M+NH4]+ 259.11109 165.4
[M+K]+ 280.04043 154.8
[M+H-H2O]+ 224.07453 144.2
[M+HCOO]- 286.07547 163.0
[M+CH3COO]- 300.09112 184.1
[M+Na-2H]- 262.05194 155.2
[M]+ 241.07672 149.0
[M]- 241.07782 149.0
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.