CID 78980240

N-[(1s)-1-(pyridin-2-yl)ethyl]methanesulfonamide

Structural Information

Molecular Formula
C8H12N2O2S
SMILES
C[C@@H](C1=CC=CC=N1)NS(=O)(=O)C
InChI
InChI=1S/C8H12N2O2S/c1-7(10-13(2,11)12)8-5-3-4-6-9-8/h3-7,10H,1-2H3/t7-/m0/s1
InChIKey
FKYZVQMLDJQCKR-ZETCQYMHSA-N
Compound name
N-[(1S)-1-pyridin-2-ylethyl]methanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

200.06195 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.06923 140.9
[M+Na]+ 223.05117 148.5
[M-H]- 199.05467 143.4
[M+NH4]+ 218.09577 158.8
[M+K]+ 239.02511 146.1
[M+H-H2O]+ 183.05921 134.4
[M+HCOO]- 245.06015 158.4
[M+CH3COO]- 259.07580 183.1
[M+Na-2H]- 221.03662 146.2
[M]+ 200.06140 142.6
[M]- 200.06250 142.6
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

patents stripe