CID 4794462

4-(morpholine-4-sulfonyl)phenol

Structural Information

Molecular Formula
C10H13NO4S
SMILES
C1COCCN1S(=O)(=O)C2=CC=C(C=C2)O
InChI
InChI=1S/C10H13NO4S/c12-9-1-3-10(4-2-9)16(13,14)11-5-7-15-8-6-11/h1-4,12H,5-8H2
InChIKey
LYIHIMLRHVZNJK-UHFFFAOYSA-N
Compound name
4-morpholin-4-ylsulfonylphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

33
Patents

243.05653 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.06381 149.7
[M+Na]+ 266.04575 156.3
[M-H]- 242.04925 154.1
[M+NH4]+ 261.09035 163.9
[M+K]+ 282.01969 154.5
[M+H-H2O]+ 226.05379 142.9
[M+HCOO]- 288.05473 162.2
[M+CH3COO]- 302.07038 183.3
[M+Na-2H]- 264.03120 154.6
[M]+ 243.05598 148.8
[M]- 243.05708 148.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe