CID 3075541

185759-05-1

Structural Information

Molecular Formula
C19H20ClNO4
SMILES
C1COC(CN1CCOC(=O)OC2=CC=CC=C2)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C19H20ClNO4/c20-16-8-6-15(7-9-16)18-14-21(10-12-23-18)11-13-24-19(22)25-17-4-2-1-3-5-17/h1-9,18H,10-14H2
InChIKey
DQXNORXQDGQGAW-UHFFFAOYSA-N
Compound name
2-[2-(4-chlorophenyl)morpholin-4-yl]ethyl phenyl carbonate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

361.1081 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 362.11538 183.4
[M+Na]+ 384.09732 198.1
[M+NH4]+ 379.14192 190.9
[M+K]+ 400.07126 190.1
[M-H]- 360.10082 189.8
[M+Na-2H]- 382.08277 191.6
[M]+ 361.10755 187.6
[M]- 361.10865 187.6
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.