CID 215290

35382-75-3

Structural Information

Molecular Formula
C16H13ClN2O3
SMILES
C1=CC=C(C=C1)C2C3=C(C=CC(=C3)Cl)N(C(=O)O2)CC(=O)N
InChI
InChI=1S/C16H13ClN2O3/c17-11-6-7-13-12(8-11)15(10-4-2-1-3-5-10)22-16(21)19(13)9-14(18)20/h1-8,15H,9H2,(H2,18,20)
InChIKey
WJEHXPYVLUZSBV-UHFFFAOYSA-N
Compound name
2-(6-chloro-2-oxo-4-phenyl-4H-3,1-benzoxazin-1-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

316.06146 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 317.068736 171.1
[M+Na]+ 339.050678 179.9
[M-H]- 315.054184 177.5
[M+NH4]+ 334.095283 184.2
[M+K]+ 355.024618 175.3
[M+H-H2O]+ 299.058720 163.0
[M+HCOO]- 361.059661 185.1
[M+CH3COO]- 375.075311 182.0
[M+Na-2H]- 337.036126 174.8
[M]+ 316.06091142 172.4
[M]- 316.06200858 172.4
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.