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 185.7
[M+Na]+ 397.10562 190.8
[M-H]- 373.10912 189.1
[M+NH4]+ 392.15022 197.5
[M+K]+ 413.07956 185.4
[M+H-H2O]+ 357.11366 178.0
[M+HCOO]- 419.11460 194.7
[M+CH3COO]- 433.13025 215.7
[M+Na-2H]- 395.09107 185.3
[M]+ 374.11585 188.7
[M]- 374.11695 188.7
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.