CID 7275249

5-(2-chlorophenyl)-n-cyclopentyl-2-furamide

Structural Information

Molecular Formula
C16H16ClNO2
SMILES
C1CCC(C1)NC(=O)C2=CC=C(O2)C3=CC=CC=C3Cl
InChI
InChI=1S/C16H16ClNO2/c17-13-8-4-3-7-12(13)14-9-10-15(20-14)16(19)18-11-5-1-2-6-11/h3-4,7-11H,1-2,5-6H2,(H,18,19)
InChIKey
UMDNYQVQMBGNLQ-UHFFFAOYSA-N
Compound name
5-(2-chlorophenyl)-N-cyclopentylfuran-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

289.08694 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 290.094216 168.7
[M+Na]+ 312.076158 175.3
[M-H]- 288.079664 179.0
[M+NH4]+ 307.120763 186.6
[M+K]+ 328.050098 171.1
[M+H-H2O]+ 272.084200 162.2
[M+HCOO]- 334.085141 187.5
[M+CH3COO]- 348.100791 180.7
[M+Na-2H]- 310.061606 168.7
[M]+ 289.08639142 169.0
[M]- 289.08748858 169.0
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.