CID 50988906

1182992-49-9

Structural Information

Molecular Formula
C11H12ClNO2
SMILES
C1C(OC2=CC=CC=C21)CNC(=O)CCl
InChI
InChI=1S/C11H12ClNO2/c12-6-11(14)13-7-9-5-8-3-1-2-4-10(8)15-9/h1-4,9H,5-7H2,(H,13,14)
InChIKey
ILTSQTKIVKMQTP-UHFFFAOYSA-N
Compound name
2-chloro-N-(2,3-dihydro-1-benzofuran-2-ylmethyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

225.05565 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.062926 148.8
[M+Na]+ 248.044868 156.6
[M-H]- 224.048374 153.6
[M+NH4]+ 243.089473 169.1
[M+K]+ 264.018808 153.5
[M+H-H2O]+ 208.052910 143.8
[M+HCOO]- 270.053851 167.0
[M+CH3COO]- 284.069501 188.2
[M+Na-2H]- 246.030316 154.3
[M]+ 225.05510142 151.3
[M]- 225.05619858 151.3
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.