CID 15556

1703-32-8

Structural Information

Molecular Formula
C17H23NO6
SMILES
CCOC(=O)OC1=C(C=C(C=C1OC)C(=O)N2CCCCC2)OC
InChI
InChI=1S/C17H23NO6/c1-4-23-17(20)24-15-13(21-2)10-12(11-14(15)22-3)16(19)18-8-6-5-7-9-18/h10-11H,4-9H2,1-3H3
InChIKey
BRKLZMLKIKEGJW-UHFFFAOYSA-N
Compound name
[2,6-dimethoxy-4-(piperidine-1-carbonyl)phenyl] ethyl carbonate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

337.15253 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.15981 177.0
[M+Na]+ 360.14175 181.5
[M-H]- 336.14525 181.5
[M+NH4]+ 355.18635 188.9
[M+K]+ 376.11569 181.1
[M+H-H2O]+ 320.14979 168.1
[M+HCOO]- 382.15073 194.3
[M+CH3COO]- 396.16638 208.9
[M+Na-2H]- 358.12720 176.6
[M]+ 337.15198 180.4
[M]- 337.15308 180.4
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.