CID 26784

5-methoxy-3-(2-piperidinoethyl)-2-benzoxazolinone hydrochloride

Structural Information

Molecular Formula
C15H20N2O3
SMILES
COC1=CC2=C(C=C1)OC(=O)N2CCN3CCCCC3
InChI
InChI=1S/C15H20N2O3/c1-19-12-5-6-14-13(11-12)17(15(18)20-14)10-9-16-7-3-2-4-8-16/h5-6,11H,2-4,7-10H2,1H3
InChIKey
RZVJFHRBGIETET-UHFFFAOYSA-N
Compound name
5-methoxy-3-(2-piperidin-1-ylethyl)-1,3-benzoxazol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

276.1474 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.154676 162.1
[M+Na]+ 299.136618 170.4
[M-H]- 275.140124 167.6
[M+NH4]+ 294.181223 177.1
[M+K]+ 315.110558 167.8
[M+H-H2O]+ 259.144660 153.4
[M+HCOO]- 321.145601 181.0
[M+CH3COO]- 335.161251 173.9
[M+Na-2H]- 297.122066 166.2
[M]+ 276.14685142 164.5
[M]- 276.14794858 164.5
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.