CID 9589061

Brn 4264417

Structural Information

Molecular Formula
C15H18ClN3O2
SMILES
C/C(=N\NC(=O)C(=O)N1CCCCC1)/C2=CC=CC=C2Cl
InChI
InChI=1S/C15H18ClN3O2/c1-11(12-7-3-4-8-13(12)16)17-18-14(20)15(21)19-9-5-2-6-10-19/h3-4,7-8H,2,5-6,9-10H2,1H3,(H,18,20)/b17-11+
InChIKey
URMFHRFOZHAJGB-GZTJUZNOSA-N
Compound name
N-[(E)-1-(2-chlorophenyl)ethylideneamino]-2-oxo-2-piperidin-1-ylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

307.10876 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 308.11604 171.2
[M+Na]+ 330.09798 174.9
[M-H]- 306.10148 176.6
[M+NH4]+ 325.14258 184.9
[M+K]+ 346.07192 171.1
[M+H-H2O]+ 290.10602 162.8
[M+HCOO]- 352.10696 186.7
[M+CH3COO]- 366.12261 207.6
[M+Na-2H]- 328.08343 172.4
[M]+ 307.10821 168.6
[M]- 307.10931 168.6
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.