CID 198045

264 cp

Structural Information

Molecular Formula
C17H23ClN2O2
SMILES
C=CCOC1=C(C=CC(=C1)Cl)C(=O)NCCN2CCCCC2
InChI
InChI=1S/C17H23ClN2O2/c1-2-12-22-16-13-14(18)6-7-15(16)17(21)19-8-11-20-9-4-3-5-10-20/h2,6-7,13H,1,3-5,8-12H2,(H,19,21)
InChIKey
JUHWMDGJJNVWIZ-UHFFFAOYSA-N
Compound name
4-chloro-N-(2-piperidin-1-ylethyl)-2-prop-2-enoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

322.1448 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.15208 176.4
[M+Na]+ 345.13402 187.9
[M+NH4]+ 340.17862 183.5
[M+K]+ 361.10796 179.8
[M-H]- 321.13752 179.6
[M+Na-2H]- 343.11947 182.1
[M]+ 322.14425 179.0
[M]- 322.14535 179.0
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

patents stripe