CID 63089509

1341509-13-4

Structural Information

Molecular Formula
C9H14N2O2S
SMILES
CC1=CC(=CC(=C1C)NC)S(=O)(=O)N
InChI
InChI=1S/C9H14N2O2S/c1-6-4-8(14(10,12)13)5-9(11-3)7(6)2/h4-5,11H,1-3H3,(H2,10,12,13)
InChIKey
YGOVJYWKFQJYEI-UHFFFAOYSA-N
Compound name
3,4-dimethyl-5-(methylamino)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

214.0776 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.08488 144.2
[M+Na]+ 237.06682 153.2
[M-H]- 213.07032 148.2
[M+NH4]+ 232.11142 163.1
[M+K]+ 253.04076 149.8
[M+H-H2O]+ 197.07486 138.4
[M+HCOO]- 259.07580 163.7
[M+CH3COO]- 273.09145 190.7
[M+Na-2H]- 235.05227 147.5
[M]+ 214.07705 145.6
[M]- 214.07815 145.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.