CID 964635

4-(1-naphthylsulfonyl)morpholine

Structural Information

Molecular Formula
C14H15NO3S
SMILES
C1COCCN1S(=O)(=O)C2=CC=CC3=CC=CC=C32
InChI
InChI=1S/C14H15NO3S/c16-19(17,15-8-10-18-11-9-15)14-7-3-5-12-4-1-2-6-13(12)14/h1-7H,8-11H2
InChIKey
IXFFHUDQCVBCGR-UHFFFAOYSA-N
Compound name
4-naphthalen-1-ylsulfonylmorpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

3
Patents

277.07727 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.08455 158.6
[M+Na]+ 300.06649 165.7
[M-H]- 276.06999 164.9
[M+NH4]+ 295.11109 173.0
[M+K]+ 316.04043 162.8
[M+H-H2O]+ 260.07453 151.0
[M+HCOO]- 322.07547 171.0
[M+CH3COO]- 336.09112 169.8
[M+Na-2H]- 298.05194 165.1
[M]+ 277.07672 158.3
[M]- 277.07782 158.3
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