CID 6479567

1-piperidineacetic acid, phenacylidenehydrazide, hydrochloride

Structural Information

Molecular Formula
C15H19N3O2
SMILES
C1CCN(CC1)CC(=O)N/N=C/C(=O)C2=CC=CC=C2
InChI
InChI=1S/C15H19N3O2/c19-14(13-7-3-1-4-8-13)11-16-17-15(20)12-18-9-5-2-6-10-18/h1,3-4,7-8,11H,2,5-6,9-10,12H2,(H,17,20)/b16-11+
InChIKey
XPAHRNDRSYRVOE-LFIBNONCSA-N
Compound name
N-[(E)-phenacylideneamino]-2-piperidin-1-ylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

273.14774 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.15502 163.5
[M+Na]+ 296.13696 165.5
[M-H]- 272.14046 168.4
[M+NH4]+ 291.18156 177.2
[M+K]+ 312.11090 162.9
[M+H-H2O]+ 256.14500 153.9
[M+HCOO]- 318.14594 184.5
[M+CH3COO]- 332.16159 203.2
[M+Na-2H]- 294.12241 167.1
[M]+ 273.14719 158.9
[M]- 273.14829 158.9
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.