CID 29083

Caroxazone

Structural Information

Molecular Formula
C10H10N2O3
SMILES
C1C2=CC=CC=C2OC(=O)N1CC(=O)N
InChI
InChI=1S/C10H10N2O3/c11-9(13)6-12-5-7-3-1-2-4-8(7)15-10(12)14/h1-4H,5-6H2,(H2,11,13)
InChIKey
KYCBWEZLKCTALM-UHFFFAOYSA-N
Compound name
2-(2-oxo-4H-1,3-benzoxazin-3-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

12
References

3638
Patents

206.06914 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.07642 142.0
[M+Na]+ 229.05836 149.7
[M-H]- 205.06186 145.3
[M+NH4]+ 224.10296 158.7
[M+K]+ 245.03230 148.4
[M+H-H2O]+ 189.06640 134.9
[M+HCOO]- 251.06734 161.4
[M+CH3COO]- 265.08299 187.2
[M+Na-2H]- 227.04381 148.6
[M]+ 206.06859 140.7
[M]- 206.06969 140.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe