CID 212319

24132-23-8

Structural Information

Molecular Formula
C14H16N2O3
SMILES
C1CCN(CC1)C(=O)C2C(=O)NC3=CC=CC=C3O2
InChI
InChI=1S/C14H16N2O3/c17-13-12(14(18)16-8-4-1-5-9-16)19-11-7-3-2-6-10(11)15-13/h2-3,6-7,12H,1,4-5,8-9H2,(H,15,17)
InChIKey
PXLVMVNPQMXQJC-UHFFFAOYSA-N
Compound name
2-(piperidine-1-carbonyl)-4H-1,4-benzoxazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

260.1161 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.12338 159.1
[M+Na]+ 283.10532 163.7
[M-H]- 259.10882 161.9
[M+NH4]+ 278.14992 171.3
[M+K]+ 299.07926 160.8
[M+H-H2O]+ 243.11336 150.0
[M+HCOO]- 305.11430 170.9
[M+CH3COO]- 319.12995 168.4
[M+Na-2H]- 281.09077 162.9
[M]+ 260.11555 152.5
[M]- 260.11665 152.5
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.