CID 3075553

185759-12-0

Structural Information

Molecular Formula
C17H24N2O4
SMILES
C1COCCN1C(=O)OCCN2CCOC(C2)C3=CC=CC=C3
InChI
InChI=1S/C17H24N2O4/c20-17(19-8-10-21-11-9-19)23-13-7-18-6-12-22-16(14-18)15-4-2-1-3-5-15/h1-5,16H,6-14H2
InChIKey
ZAERPGDKBCDDON-UHFFFAOYSA-N
Compound name
2-(2-phenylmorpholin-4-yl)ethyl morpholine-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

320.1736 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 321.18088 177.2
[M+Na]+ 343.16282 178.5
[M-H]- 319.16632 183.0
[M+NH4]+ 338.20742 184.5
[M+K]+ 359.13676 178.2
[M+H-H2O]+ 303.17086 165.9
[M+HCOO]- 365.17180 188.6
[M+CH3COO]- 379.18745 203.1
[M+Na-2H]- 341.14827 179.3
[M]+ 320.17305 172.7
[M]- 320.17415 172.7
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.