| SpectraBase Spectrum ID |
HJGbH1TNViU |
| Name |
1,2-Benzenediol, o,o'-di(isobutoxycarbonyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
310.141638422 u |
| Formula |
C16H22O6 |
| InChI |
InChI=1S/C16H22O6/c1-11(2)9-19-15(17)21-13-7-5-6-8-14(13)22-16(18)20-10-12(3)4/h5-8,11-12H,9-10H2,1-4H3 |
| InChIKey |
NCKNEXUTRGASGF-UHFFFAOYSA-N |
| Molecular Weight |
310.346 g/mol |
| SMILES |
CC(C)COC(OC=1C(=CC=CC1)OC(OCC(C)C)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.91601 |
