CID 15555

1703-31-7

Structural Information

Molecular Formula
C16H21NO7
SMILES
CCOC(=O)OC1=C(C=C(C=C1OC)C(=O)N2CCOCC2)OC
InChI
InChI=1S/C16H21NO7/c1-4-23-16(19)24-14-12(20-2)9-11(10-13(14)21-3)15(18)17-5-7-22-8-6-17/h9-10H,4-8H2,1-3H3
InChIKey
SFVJZJHVCCHUGR-UHFFFAOYSA-N
Compound name
[2,6-dimethoxy-4-(morpholine-4-carbonyl)phenyl] ethyl carbonate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

339.1318 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 340.13908 175.6
[M+Na]+ 362.12102 180.5
[M-H]- 338.12452 181.0
[M+NH4]+ 357.16562 186.0
[M+K]+ 378.09496 181.8
[M+H-H2O]+ 322.12906 166.6
[M+HCOO]- 384.13000 192.5
[M+CH3COO]- 398.14565 208.4
[M+Na-2H]- 360.10647 176.6
[M]+ 339.13125 180.7
[M]- 339.13235 180.7
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.