CID 9581574

N-(4-methylbenzylidene)-4-methylbenzenesulfonamide

Structural Information

Molecular Formula
C15H15NO2S
SMILES
CC1=CC=C(C=C1)/C=N/S(=O)(=O)C2=CC=C(C=C2)C
InChI
InChI=1S/C15H15NO2S/c1-12-3-7-14(8-4-12)11-16-19(17,18)15-9-5-13(2)6-10-15/h3-11H,1-2H3/b16-11+
InChIKey
CEZQVKAFKQRFDG-LFIBNONCSA-N
Compound name
(NE)-4-methyl-N-[(4-methylphenyl)methylidene]benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

273.08234 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.089616 160.6
[M+Na]+ 296.071558 169.6
[M-H]- 272.075064 169.3
[M+NH4]+ 291.116163 177.9
[M+K]+ 312.045498 165.0
[M+H-H2O]+ 256.079600 153.1
[M+HCOO]- 318.080541 181.4
[M+CH3COO]- 332.096191 199.8
[M+Na-2H]- 294.057006 165.3
[M]+ 273.08179142 164.3
[M]- 273.08288858 164.3
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