SpectraBase Spectrum ID |
GeBmwrMCgYy |
Name |
Oxazole-5-one, 4,5-dihydro-2-methyl-4-[[5-acetoxy-4-methoxyphenyl]ethylene]- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
275.079372518 u |
Formula |
C14H13NO5 |
InChI |
InChI=1S/C14H13NO5/c1-8-15-11(14(17)19-8)6-10-4-5-12(18-3)13(7-10)20-9(2)16/h4-7H,1-3H3/b11-6- |
InChIKey |
NHWRTLRYGLPIGJ-WDZFZDKYSA-N |
SMILES |
C1(=CC(=C(C=C1)OC)OC(C)=O)\C=C\1C(OC(=N1)C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.915011 |