CID 30018

20224-22-0

Structural Information

Molecular Formula
C15H21ClN2O2
SMILES
CC1=C(C=C(C=C1)NC(=O)OCCN2CCCCC2)Cl
InChI
InChI=1S/C15H21ClN2O2/c1-12-5-6-13(11-14(12)16)17-15(19)20-10-9-18-7-3-2-4-8-18/h5-6,11H,2-4,7-10H2,1H3,(H,17,19)
InChIKey
YBRYFZCARLZZBN-UHFFFAOYSA-N
Compound name
2-piperidin-1-ylethyl N-(3-chloro-4-methylphenyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

296.12915 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.136426 169.2
[M+Na]+ 319.118368 174.1
[M-H]- 295.121874 173.3
[M+NH4]+ 314.162973 183.5
[M+K]+ 335.092308 169.6
[M+H-H2O]+ 279.126410 161.2
[M+HCOO]- 341.127351 183.7
[M+CH3COO]- 355.143001 202.3
[M+Na-2H]- 317.103816 171.1
[M]+ 296.12860142 168.4
[M]- 296.12969858 168.4
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.