| SpectraBase Spectrum ID |
FLBujZmoQNG |
| Name |
1,4-Diacetoxy-2,5-dimethyl-naphthalene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
272.104858991 u |
| Formula |
C16H16O4 |
| InChI |
InChI=1S/C16H16O4/c1-9-6-5-7-13-15(9)14(19-11(3)17)8-10(2)16(13)20-12(4)18/h5-8H,1-4H3 |
| InChIKey |
VOFJVXDJLWIHJC-UHFFFAOYSA-N |
| Molecular Weight |
272.300 g/mol |
| SMILES |
C1(OC(=O)C)=CC(=C(OC(=O)C)C2=C1C(C)=CC=C2)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.921181 |
