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

1
Patents

340.16342 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 341.17070 178.7
[M+Na]+ 363.15264 182.7
[M-H]- 339.15614 183.9
[M+NH4]+ 358.19724 188.9
[M+K]+ 379.12658 183.4
[M+H-H2O]+ 323.16068 169.1
[M+HCOO]- 385.16162 197.3
[M+CH3COO]- 399.17727 211.8
[M+Na-2H]- 361.13809 181.1
[M]+ 340.16287 182.9
[M]- 340.16397 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