CID 4494604

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

Structural Information

Molecular Formula
C14H14ClNO2
SMILES
CC(C)NC(=O)C1=CC=C(O1)C2=CC=CC=C2Cl
InChI
InChI=1S/C14H14ClNO2/c1-9(2)16-14(17)13-8-7-12(18-13)10-5-3-4-6-11(10)15/h3-9H,1-2H3,(H,16,17)
InChIKey
ACKWVASVFBTRST-UHFFFAOYSA-N
Compound name
5-(2-chlorophenyl)-N-propan-2-ylfuran-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

263.07132 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.07860 159.0
[M+Na]+ 286.06054 172.0
[M+NH4]+ 281.10514 167.3
[M+K]+ 302.03448 167.2
[M-H]- 262.06404 164.1
[M+Na-2H]- 284.04599 165.8
[M]+ 263.07077 162.5
[M]- 263.07187 162.5
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.