CID 80645

4-tosylmorpholine

Structural Information

Molecular Formula

C₁₁H₁₅NO₃S

SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2

InChI

InChI=1S/C11H15NO3S/c1-10-2-4-11(5-3-10)16(13,14)12-6-8-15-9-7-12/h2-5H,6-9H2,1H3

InChIKey

NBTTYMBZXDHFCP-UHFFFAOYSA-N

Compound name

4-(4-methylphenyl)sulfonylmorpholine

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 2
References: 235
Patents: 241.07727 Da
Monoisotopic Mass: 1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	242.08455	151.2
[M+Na]+	264.06649	163.2
[M+NH4]+	259.11109	159.0
[M+K]+	280.04043	156.1
[M-H]-	240.06999	154.9
[M+Na-2H]-	262.05194	157.4
[M]+	241.07672	154.4
[M]-	241.07782	154.4

Literature stripe

literature stripe

Patent stripe

patents stripe