CID 3075537

185759-03-9

Structural Information

Molecular Formula
C19H21NO4
SMILES
C1COC(CN1CCOC(=O)OC2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C19H21NO4/c21-19(24-17-9-5-2-6-10-17)23-14-12-20-11-13-22-18(15-20)16-7-3-1-4-8-16/h1-10,18H,11-15H2
InChIKey
CFXKDMQBSYXROX-UHFFFAOYSA-N
Compound name
phenyl 2-(2-phenylmorpholin-4-yl)ethyl carbonate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

327.14706 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 328.154336 177.2
[M+Na]+ 350.136278 180.5
[M-H]- 326.139784 184.7
[M+NH4]+ 345.180883 187.1
[M+K]+ 366.110218 178.6
[M+H-H2O]+ 310.144320 166.5
[M+HCOO]- 372.145261 194.5
[M+CH3COO]- 386.160911 204.8
[M+Na-2H]- 348.121726 180.8
[M]+ 327.14651142 176.5
[M]- 327.14760858 176.5
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.