CID 2060576

5-(chloroacetyl)-1,3-dihydro-2h-indol-2-one

Structural Information

Molecular Formula
C10H8ClNO2
SMILES
C1C2=C(C=CC(=C2)C(=O)CCl)NC1=O
InChI
InChI=1S/C10H8ClNO2/c11-5-9(13)6-1-2-8-7(3-6)4-10(14)12-8/h1-3H,4-5H2,(H,12,14)
InChIKey
WXJWBEAGVWVEDM-UHFFFAOYSA-N
Compound name
5-(2-chloroacetyl)-1,3-dihydroindol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

361
Patents

209.02435 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.03163 142.2
[M+Na]+ 232.01357 151.9
[M-H]- 208.01707 144.2
[M+NH4]+ 227.05817 162.8
[M+K]+ 247.98751 146.8
[M+H-H2O]+ 192.02161 137.2
[M+HCOO]- 254.02255 158.0
[M+CH3COO]- 268.03820 181.4
[M+Na-2H]- 229.99902 145.9
[M]+ 209.02380 142.7
[M]- 209.02490 142.7
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