CID 6479577

1-piperidineacetic acid, (p-phenoxyphenacylidene)hydrazide, hydrochloride

Structural Information

Molecular Formula
C21H23N3O3
SMILES
C1CCN(CC1)CC(=O)N/N=C/C(=O)C2=CC=C(C=C2)OC3=CC=CC=C3
InChI
InChI=1S/C21H23N3O3/c25-20(15-22-23-21(26)16-24-13-5-2-6-14-24)17-9-11-19(12-10-17)27-18-7-3-1-4-8-18/h1,3-4,7-12,15H,2,5-6,13-14,16H2,(H,23,26)/b22-15+
InChIKey
OJGLOBXGIPLRJM-PXLXIMEGSA-N
Compound name
N-[(E)-[2-oxo-2-(4-phenoxyphenyl)ethylidene]amino]-2-piperidin-1-ylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

365.17395 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 366.18123 188.3
[M+Na]+ 388.16317 199.0
[M+NH4]+ 383.20777 194.4
[M+K]+ 404.13711 191.8
[M-H]- 364.16667 193.9
[M+Na-2H]- 386.14862 196.6
[M]+ 365.17340 191.0
[M]- 365.17450 191.0
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.