CID 6460303

N-(4-methoxybenzyl)-n-methylmethanesulfonamide

Structural Information

Molecular Formula
C10H15NO3S
SMILES
CN(CC1=CC=C(C=C1)OC)S(=O)(=O)C
InChI
InChI=1S/C10H15NO3S/c1-11(15(3,12)13)8-9-4-6-10(14-2)7-5-9/h4-7H,8H2,1-3H3
InChIKey
WGQLJNNCVCEPNS-UHFFFAOYSA-N
Compound name
N-[(4-methoxyphenyl)methyl]-N-methylmethanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

118
Patents

229.07727 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.08455 147.9
[M+Na]+ 252.06649 155.8
[M-H]- 228.06999 153.4
[M+NH4]+ 247.11109 167.0
[M+K]+ 268.04043 154.6
[M+H-H2O]+ 212.07453 141.6
[M+HCOO]- 274.07547 167.8
[M+CH3COO]- 288.09112 192.4
[M+Na-2H]- 250.05194 152.2
[M]+ 229.07672 153.6
[M]- 229.07782 153.6
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