CID 28060

K 922

Structural Information

Molecular Formula
C17H24Cl2N2O3
SMILES
CCCOC1=CC(=C(C(=C1)Cl)NC(=O)OCCN2CCCCC2)Cl
InChI
InChI=1S/C17H24Cl2N2O3/c1-2-9-23-13-11-14(18)16(15(19)12-13)20-17(22)24-10-8-21-6-4-3-5-7-21/h11-12H,2-10H2,1H3,(H,20,22)
InChIKey
RCRVGKUVIXTMCI-UHFFFAOYSA-N
Compound name
2-piperidin-1-ylethyl N-(2,6-dichloro-4-propoxyphenyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

374.1164 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 375.12368 184.7
[M+Na]+ 397.10562 196.5
[M+NH4]+ 392.15022 191.5
[M+K]+ 413.07956 188.6
[M-H]- 373.10912 187.5
[M+Na-2H]- 395.09107 189.7
[M]+ 374.11585 187.5
[M]- 374.11695 187.5
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.