CID 7275248

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

Structural Information

Molecular Formula
C17H18ClNO2
SMILES
C1CCC(CC1)NC(=O)C2=CC=C(O2)C3=CC=CC=C3Cl
InChI
InChI=1S/C17H18ClNO2/c18-14-9-5-4-8-13(14)15-10-11-16(21-15)17(20)19-12-6-2-1-3-7-12/h4-5,8-12H,1-3,6-7H2,(H,19,20)
InChIKey
QFBURAGAYNSEMQ-UHFFFAOYSA-N
Compound name
5-(2-chlorophenyl)-N-cyclohexylfuran-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

303.1026 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.10988 171.8
[M+Na]+ 326.09182 177.1
[M-H]- 302.09532 181.3
[M+NH4]+ 321.13642 187.1
[M+K]+ 342.06576 172.7
[M+H-H2O]+ 286.09986 164.3
[M+HCOO]- 348.10080 188.0
[M+CH3COO]- 362.11645 182.6
[M+Na-2H]- 324.07727 172.8
[M]+ 303.10205 170.2
[M]- 303.10315 170.2
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.