CID 2794787

N-(3-formylphenyl)methanesulfonamide

Structural Information

Molecular Formula
C8H9NO3S
SMILES
CS(=O)(=O)NC1=CC=CC(=C1)C=O
InChI
InChI=1S/C8H9NO3S/c1-13(11,12)9-8-4-2-3-7(5-8)6-10/h2-6,9H,1H3
InChIKey
CBDSSTWZEANOCR-UHFFFAOYSA-N
Compound name
N-(3-formylphenyl)methanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

134
Patents

199.03032 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.03760 140.9
[M+Na]+ 222.01954 151.8
[M+NH4]+ 217.06414 148.2
[M+K]+ 237.99348 145.0
[M-H]- 198.02304 141.8
[M+Na-2H]- 220.00499 146.6
[M]+ 199.02977 143.0
[M]- 199.03087 143.0
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

patents stripe