CID 9589059

Brn 4253819

Structural Information

Molecular Formula
C10H11ClN2OS
SMILES
C/C(=N\NC(=O)CS)/C1=CC=CC=C1Cl
InChI
InChI=1S/C10H11ClN2OS/c1-7(12-13-10(14)6-15)8-4-2-3-5-9(8)11/h2-5,15H,6H2,1H3,(H,13,14)/b12-7+
InChIKey
WSJKFPNOYOVATL-KPKJPENVSA-N
Compound name
N-[(E)-1-(2-chlorophenyl)ethylideneamino]-2-sulfanylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

242.02806 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.03534 152.3
[M+Na]+ 265.01728 163.4
[M+NH4]+ 260.06188 160.8
[M+K]+ 280.99122 154.8
[M-H]- 241.02078 155.4
[M+Na-2H]- 263.00273 158.3
[M]+ 242.02751 155.3
[M]- 242.02861 155.3
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.