CID 28054

K 920

Structural Information

Molecular Formula
C15H20Cl2N2O3
SMILES
COC1=CC(=C(C(=C1)Cl)NC(=O)OCCN2CCCCC2)Cl
InChI
InChI=1S/C15H20Cl2N2O3/c1-21-11-9-12(16)14(13(17)10-11)18-15(20)22-8-7-19-5-3-2-4-6-19/h9-10H,2-8H2,1H3,(H,18,20)
InChIKey
VEUFBZUKDSTVBU-UHFFFAOYSA-N
Compound name
2-piperidin-1-ylethyl N-(2,6-dichloro-4-methoxyphenyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

346.08508 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 347.092356 176.8
[M+Na]+ 369.074298 182.8
[M-H]- 345.077804 180.6
[M+NH4]+ 364.118903 189.8
[M+K]+ 385.048238 177.9
[M+H-H2O]+ 329.082340 169.5
[M+HCOO]- 391.083281 186.5
[M+CH3COO]- 405.098931 209.9
[M+Na-2H]- 367.059746 177.4
[M]+ 346.08453142 179.2
[M]- 346.08562858 179.2
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.