CID 9570419

4'-chloro-2-(morpholinoimino)acetophenone

Structural Information

Molecular Formula
C12H13ClN2O2
SMILES
C1COCCN1/N=C/C(=O)C2=CC=C(C=C2)Cl
InChI
InChI=1S/C12H13ClN2O2/c13-11-3-1-10(2-4-11)12(16)9-14-15-5-7-17-8-6-15/h1-4,9H,5-8H2/b14-9+
InChIKey
FFLPYDKLMZFJEF-NTEUORMPSA-N
Compound name
(2E)-1-(4-chlorophenyl)-2-morpholin-4-yliminoethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

252.06656 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.07384 155.4
[M+Na]+ 275.05578 161.4
[M-H]- 251.05928 161.7
[M+NH4]+ 270.10038 170.4
[M+K]+ 291.02972 158.8
[M+H-H2O]+ 235.06382 147.3
[M+HCOO]- 297.06476 171.6
[M+CH3COO]- 311.08041 194.6
[M+Na-2H]- 273.04123 160.7
[M]+ 252.06601 155.0
[M]- 252.06711 155.0
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.