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]+ 290.09422 168.7
[M+Na]+ 312.07616 175.3
[M-H]- 288.07966 179.0
[M+NH4]+ 307.12076 186.6
[M+K]+ 328.05010 171.1
[M+H-H2O]+ 272.08420 162.2
[M+HCOO]- 334.08514 187.5
[M+CH3COO]- 348.10079 180.7
[M+Na-2H]- 310.06161 168.7
[M]+ 289.08639 169.0
[M]- 289.08749 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.