CID 3072621

143503-29-1

Structural Information

Molecular Formula
C23H38N2O4
SMILES
CCCCCCOC1=CC=CC=C1NC(=O)OC(CN2CCCC2)COCCC
InChI
InChI=1S/C23H38N2O4/c1-3-5-6-11-17-28-22-13-8-7-12-21(22)24-23(26)29-20(19-27-16-4-2)18-25-14-9-10-15-25/h7-8,12-13,20H,3-6,9-11,14-19H2,1-2H3,(H,24,26)
InChIKey
XXDMQVXIMCZJLH-UHFFFAOYSA-N
Compound name
(1-propoxy-3-pyrrolidin-1-ylpropan-2-yl) N-(2-hexoxyphenyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

406.28317 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 407.29045 204.6
[M+Na]+ 429.27239 210.9
[M+NH4]+ 424.31699 209.0
[M+K]+ 445.24633 206.4
[M-H]- 405.27589 205.6
[M+Na-2H]- 427.25784 206.6
[M]+ 406.28262 205.2
[M]- 406.28372 205.2
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.