CID 6518110

Acetophenone, o-(morpholinocarbonylmethyl)oxime

Structural Information

Molecular Formula
C14H18N2O3
SMILES
C/C(=N/OCC(=O)N1CCOCC1)/C2=CC=CC=C2
InChI
InChI=1S/C14H18N2O3/c1-12(13-5-3-2-4-6-13)15-19-11-14(17)16-7-9-18-10-8-16/h2-6H,7-11H2,1H3/b15-12-
InChIKey
PHUJQGBZOXJEBB-QINSGFPZSA-N
Compound name
1-morpholin-4-yl-2-[(Z)-1-phenylethylideneamino]oxyethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

262.13174 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.139016 160.8
[M+Na]+ 285.120958 163.9
[M-H]- 261.124464 166.7
[M+NH4]+ 280.165563 174.1
[M+K]+ 301.094898 163.7
[M+H-H2O]+ 245.129000 151.5
[M+HCOO]- 307.129941 180.2
[M+CH3COO]- 321.145591 198.1
[M+Na-2H]- 283.106406 165.2
[M]+ 262.13119142 159.3
[M]- 262.13228858 159.3
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.