CID 3051917

Carbamic acid, (3,4,5-trimethoxyphenyl)-, 2-(4-morpholinyl)ethyl ester

Structural Information

Molecular Formula
C16H24N2O6
SMILES
COC1=CC(=CC(=C1OC)OC)NC(=O)OCCN2CCOCC2
InChI
InChI=1S/C16H24N2O6/c1-20-13-10-12(11-14(21-2)15(13)22-3)17-16(19)24-9-6-18-4-7-23-8-5-18/h10-11H,4-9H2,1-3H3,(H,17,19)
InChIKey
XCPUVYWHMNOJJF-UHFFFAOYSA-N
Compound name
2-morpholin-4-ylethyl N-(3,4,5-trimethoxyphenyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

340.16342 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 341.170696 178.7
[M+Na]+ 363.152638 182.7
[M-H]- 339.156144 183.9
[M+NH4]+ 358.197243 188.9
[M+K]+ 379.126578 183.4
[M+H-H2O]+ 323.160680 169.1
[M+HCOO]- 385.161621 197.3
[M+CH3COO]- 399.177271 211.8
[M+Na-2H]- 361.138086 181.1
[M]+ 340.16287142 182.9
[M]- 340.16396858 182.9
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

patents stripe