SpectraBase Spectrum ID |
DaGrFD5d4Kp |
Name |
Benzo[E][1,3]oxazin-4-one, 2-(2-chlorophenyl)-2,3-dihydro- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
259.040006264 u |
Formula |
C14H10ClNO2 |
InChI |
InChI=1S/C14H10ClNO2/c15-11-7-3-1-5-9(11)14-16-13(17)10-6-2-4-8-12(10)18-14/h1-8,14H,(H,16,17) |
InChIKey |
WCWMJTIWVYWUHJ-UHFFFAOYSA-N |
Molecular Weight |
259.692 g/mol |
SMILES |
C1(NC(=O)C=2C(O1)=CC=CC2)C=1C(Cl)=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.921019 |