CID 18354411

Benzyl 2-acetylmorpholine-4-carboxylate

Structural Information

Molecular Formula
C14H17NO4
SMILES
CC(=O)C1CN(CCO1)C(=O)OCC2=CC=CC=C2
InChI
InChI=1S/C14H17NO4/c1-11(16)13-9-15(7-8-18-13)14(17)19-10-12-5-3-2-4-6-12/h2-6,13H,7-10H2,1H3
InChIKey
GWWOZOYYIYINFX-UHFFFAOYSA-N
Compound name
benzyl 2-acetylmorpholine-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

263.11575 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.12303 159.7
[M+Na]+ 286.10497 170.9
[M+NH4]+ 281.14957 166.1
[M+K]+ 302.07891 166.1
[M-H]- 262.10847 162.8
[M+Na-2H]- 284.09042 164.8
[M]+ 263.11520 161.9
[M]- 263.11630 161.9
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

patents stripe