CID 9578583

27049-60-1

Structural Information

Molecular Formula
C13H18N2O2S
SMILES
CC1=CC=C(C=C1)S(=O)(=O)/N=C/N2CCCCC2
InChI
InChI=1S/C13H18N2O2S/c1-12-5-7-13(8-6-12)18(16,17)14-11-15-9-3-2-4-10-15/h5-8,11H,2-4,9-10H2,1H3/b14-11+
InChIKey
ZZLIYYNDWYWBNB-SDNWHVSQSA-N
Compound name
(NE)-4-methyl-N-(piperidin-1-ylmethylidene)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

266.1089 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.11618 159.7
[M+Na]+ 289.09812 170.7
[M+NH4]+ 284.14272 167.5
[M+K]+ 305.07206 162.3
[M-H]- 265.10162 163.0
[M+Na-2H]- 287.08357 166.6
[M]+ 266.10835 162.5
[M]- 266.10945 162.5
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

No patent data available for this compound.