CID 26786

6-chloro-3-(2-piperidinoethyl)-2-benzoxazolinone hydrochloride

Structural Information

Molecular Formula
C14H17ClN2O2
SMILES
C1CCN(CC1)CCN2C3=C(C=C(C=C3)Cl)OC2=O
InChI
InChI=1S/C14H17ClN2O2/c15-11-4-5-12-13(10-11)19-14(18)17(12)9-8-16-6-2-1-3-7-16/h4-5,10H,1-3,6-9H2
InChIKey
BALVCOFWJSAMMQ-UHFFFAOYSA-N
Compound name
6-chloro-3-(2-piperidin-1-ylethyl)-1,3-benzoxazol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

280.09787 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.10515 160.6
[M+Na]+ 303.08709 175.7
[M+NH4]+ 298.13169 169.2
[M+K]+ 319.06103 169.5
[M-H]- 279.09059 165.1
[M+Na-2H]- 301.07254 166.9
[M]+ 280.09732 164.3
[M]- 280.09842 164.3
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.