CID 3072637

143503-37-1

Structural Information

Molecular Formula
C24H40N2O4
SMILES
CCCCCCOC1=CC=CC=C1NC(=O)OC(CN2CCCCC2)COCCC
InChI
InChI=1S/C24H40N2O4/c1-3-5-6-12-18-29-23-14-9-8-13-22(23)25-24(27)30-21(20-28-17-4-2)19-26-15-10-7-11-16-26/h8-9,13-14,21H,3-7,10-12,15-20H2,1-2H3,(H,25,27)
InChIKey
KKGQEKPGEXUUIX-UHFFFAOYSA-N
Compound name
(1-piperidin-1-yl-3-propoxypropan-2-yl) N-(2-hexoxyphenyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

420.2988 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 421.30608 208.2
[M+Na]+ 443.28802 215.5
[M+NH4]+ 438.33262 212.7
[M+K]+ 459.26196 208.6
[M-H]- 419.29152 210.0
[M+Na-2H]- 441.27347 211.0
[M]+ 420.29825 209.3
[M]- 420.29935 209.3
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.