CID 208217

Morpholine, 4-(o-benzoylbenzoyl)

Structural Information

Molecular Formula
C18H17NO3
SMILES
C1COCCN1C(=O)C2=CC=CC=C2C(=O)C3=CC=CC=C3
InChI
InChI=1S/C18H17NO3/c20-17(14-6-2-1-3-7-14)15-8-4-5-9-16(15)18(21)19-10-12-22-13-11-19/h1-9H,10-13H2
InChIKey
KTGRJLVKPKILSZ-UHFFFAOYSA-N
Compound name
[2-(morpholine-4-carbonyl)phenyl]-phenylmethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

10
References

0
Patents

295.12085 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.12813 168.4
[M+Na]+ 318.11007 172.3
[M-H]- 294.11357 176.2
[M+NH4]+ 313.15467 179.6
[M+K]+ 334.08401 169.9
[M+H-H2O]+ 278.11811 158.5
[M+HCOO]- 340.11905 185.2
[M+CH3COO]- 354.13470 200.6
[M+Na-2H]- 316.09552 171.4
[M]+ 295.12030 164.8
[M]- 295.12140 164.8
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.