CID 3700149

N-[(3,4-dimethoxyphenyl)methyl]-2,4,6-trimethylbenzene-1-sulfonamide

Structural Information

Molecular Formula
C18H23NO4S
SMILES
CC1=CC(=C(C(=C1)C)S(=O)(=O)NCC2=CC(=C(C=C2)OC)OC)C
InChI
InChI=1S/C18H23NO4S/c1-12-8-13(2)18(14(3)9-12)24(20,21)19-11-15-6-7-16(22-4)17(10-15)23-5/h6-10,19H,11H2,1-5H3
InChIKey
IJZNARCHSYINAH-UHFFFAOYSA-N
Compound name
N-[(3,4-dimethoxyphenyl)methyl]-2,4,6-trimethylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

349.13477 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 350.14205 182.7
[M+Na]+ 372.12399 195.5
[M+NH4]+ 367.16859 189.3
[M+K]+ 388.09793 187.3
[M-H]- 348.12749 186.2
[M+Na-2H]- 370.10944 189.2
[M]+ 349.13422 186.1
[M]- 349.13532 186.1
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.