CID 10015322

1-((1-oxo-1h-2-benzopyran-4-yl)carbonyl)piperidine

Structural Information

Molecular Formula
C15H15NO3
SMILES
C1CCN(CC1)C(=O)C2=COC(=O)C3=CC=CC=C32
InChI
InChI=1S/C15H15NO3/c17-14(16-8-4-1-5-9-16)13-10-19-15(18)12-7-3-2-6-11(12)13/h2-3,6-7,10H,1,4-5,8-9H2
InChIKey
KOURANDLSLPUPE-UHFFFAOYSA-N
Compound name
4-(piperidine-1-carbonyl)isochromen-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

257.1052 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.11248 156.5
[M+Na]+ 280.09442 170.8
[M+NH4]+ 275.13902 164.9
[M+K]+ 296.06836 164.0
[M-H]- 256.09792 161.7
[M+Na-2H]- 278.07987 163.5
[M]+ 257.10465 160.0
[M]- 257.10575 160.0
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.