CID 16226870

923778-56-7

Structural Information

Molecular Formula
C15H15ClN2O3
SMILES
CN(C1=CC=CC=C1C(=O)NCC2=CC=CO2)C(=O)CCl
InChI
InChI=1S/C15H15ClN2O3/c1-18(14(19)9-16)13-7-3-2-6-12(13)15(20)17-10-11-5-4-8-21-11/h2-8H,9-10H2,1H3,(H,17,20)
InChIKey
FPZCYIRLKMXFRH-UHFFFAOYSA-N
Compound name
2-[(2-chloroacetyl)-methylamino]-N-(furan-2-ylmethyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

306.07712 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.084396 172.5
[M+Na]+ 329.066338 178.6
[M-H]- 305.069844 181.1
[M+NH4]+ 324.110943 188.3
[M+K]+ 345.040278 176.4
[M+H-H2O]+ 289.074380 165.2
[M+HCOO]- 351.075321 193.3
[M+CH3COO]- 365.090971 208.0
[M+Na-2H]- 327.051786 174.6
[M]+ 306.07657142 177.2
[M]- 306.07766858 177.2
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.