CID 12364581

2-chloro-n-(4-methoxy-1,3-benzothiazol-2-yl)acetamide hydrochloride

Structural Information

Molecular Formula
C10H9ClN2O2S
SMILES
COC1=C2C(=CC=C1)SC(=N2)NC(=O)CCl
InChI
InChI=1S/C10H9ClN2O2S/c1-15-6-3-2-4-7-9(6)13-10(16-7)12-8(14)5-11/h2-4H,5H2,1H3,(H,12,13,14)
InChIKey
ASXAPLGADHCULA-UHFFFAOYSA-N
Compound name
2-chloro-N-(4-methoxy-1,3-benzothiazol-2-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

256.00732 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.01460 152.0
[M+Na]+ 278.99654 164.8
[M+NH4]+ 274.04114 160.8
[M+K]+ 294.97048 157.8
[M-H]- 255.00004 154.0
[M+Na-2H]- 276.98199 157.6
[M]+ 256.00677 155.1
[M]- 256.00787 155.1
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.