CID 205675

18464-49-8

Structural Information

Molecular Formula
C12H14N2O3
SMILES
CCC1C2=CC=CC=C2OC(=O)N1CC(=O)N
InChI
InChI=1S/C12H14N2O3/c1-2-9-8-5-3-4-6-10(8)17-12(16)14(9)7-11(13)15/h3-6,9H,2,7H2,1H3,(H2,13,15)
InChIKey
DOJCFMPXSWUBJM-UHFFFAOYSA-N
Compound name
2-(4-ethyl-2-oxo-4H-1,3-benzoxazin-3-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

234.10045 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.10773 151.6
[M+Na]+ 257.08967 159.3
[M-H]- 233.09317 154.9
[M+NH4]+ 252.13427 167.5
[M+K]+ 273.06361 157.6
[M+H-H2O]+ 217.09771 144.4
[M+HCOO]- 279.09865 170.3
[M+CH3COO]- 293.11430 194.5
[M+Na-2H]- 255.07512 156.3
[M]+ 234.09990 151.4
[M]- 234.10100 151.4
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.