CID 16078292

6-(4-chlorophenyl)-3-methyl-2-(p-tolyl)piperidin-4-one oxime

Structural Information

Molecular Formula
C19H21ClN2O
SMILES
CC\1C(NC(C/C1=N\O)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)C
InChI
InChI=1S/C19H21ClN2O/c1-12-3-5-15(6-4-12)19-13(2)17(22-23)11-18(21-19)14-7-9-16(20)10-8-14/h3-10,13,18-19,21,23H,11H2,1-2H3/b22-17+
InChIKey
WKUCVQOCDGFQCC-OQKWZONESA-N
Compound name
(NE)-N-[6-(4-chlorophenyl)-3-methyl-2-(4-methylphenyl)piperidin-4-ylidene]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

328.13425 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 329.14153 179.3
[M+Na]+ 351.12347 186.5
[M-H]- 327.12697 185.9
[M+NH4]+ 346.16807 192.0
[M+K]+ 367.09741 178.7
[M+H-H2O]+ 311.13151 170.6
[M+HCOO]- 373.13245 193.0
[M+CH3COO]- 387.14810 188.9
[M+Na-2H]- 349.10892 179.9
[M]+ 328.13370 176.1
[M]- 328.13480 176.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.