CID 2416667

2-(methylamino)-n-[2-(methylsulfanyl)phenyl]acetamide hydrochloride

Structural Information

Molecular Formula
C10H14N2OS
SMILES
CNCC(=O)NC1=CC=CC=C1SC
InChI
InChI=1S/C10H14N2OS/c1-11-7-10(13)12-8-5-3-4-6-9(8)14-2/h3-6,11H,7H2,1-2H3,(H,12,13)
InChIKey
PUZRWYXFJJLVHK-UHFFFAOYSA-N
Compound name
2-(methylamino)-N-(2-methylsulfanylphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

210.08269 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.08997 145.1
[M+Na]+ 233.07191 151.4
[M-H]- 209.07541 148.8
[M+NH4]+ 228.11651 163.9
[M+K]+ 249.04585 148.2
[M+H-H2O]+ 193.07995 138.4
[M+HCOO]- 255.08089 165.2
[M+CH3COO]- 269.09654 190.3
[M+Na-2H]- 231.05736 148.4
[M]+ 210.08214 146.3
[M]- 210.08324 146.3
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.