CID 3087048

65347-93-5

Structural Information

Molecular Formula
C19H30N2O4
SMILES
CCCCCCOC1=CC=CC(=C1)NC(=O)OCCN2CCOCC2
InChI
InChI=1S/C19H30N2O4/c1-2-3-4-5-12-24-18-8-6-7-17(16-18)20-19(22)25-15-11-21-9-13-23-14-10-21/h6-8,16H,2-5,9-15H2,1H3,(H,20,22)
InChIKey
QHJCFHSYXUONSM-UHFFFAOYSA-N
Compound name
2-morpholin-4-ylethyl N-(3-hexoxyphenyl)carbamate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

0
Patents

350.22055 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.22783 187.0
[M+Na]+ 373.20977 188.2
[M-H]- 349.21327 190.7
[M+NH4]+ 368.25437 196.3
[M+K]+ 389.18371 186.7
[M+H-H2O]+ 333.21781 176.7
[M+HCOO]- 395.21875 204.1
[M+CH3COO]- 409.23440 213.8
[M+Na-2H]- 371.19522 188.8
[M]+ 350.22000 188.5
[M]- 350.22110 188.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.