| SpectraBase Compound ID | IFEf7LqA5FD |
|---|---|
| InChI | InChI=1S/C11H6O4/c12-10-2-1-6-9(15-10)5-8-7(11(6)13)3-4-14-8/h1-5,13H |
| InChIKey | GIJHDGJRTUSBJR-UHFFFAOYSA-N |
| Mol Weight | 202.16 g/mol |
| Molecular Formula | C11H6O4 |
| Exact Mass | 202.026609 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | 7OsBXyTC6Av |
|---|---|
| Name | Bergaptol |
| Source of Sample | Indofine Chemical Company, Inc. |
| Catalog Number | 19-230 |
| Lot Number | 000216 |
| CAS Registry Number | 486-60-2 |
| Copyright | Copyright © 2012-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H6O4 |
| InChI | InChI=1S/C11H6O4/c12-10-2-1-6-9(15-10)5-8-7(11(6)13)3-4-14-8/h1-5,13H |
| InChIKey | GIJHDGJRTUSBJR-UHFFFAOYSA-N |
| Instrument Name | Bio-Rad FTS |
| SMILES | Oc1c2c(cc3OC(\C=C/c13)=O)occ2 |
| Source of Spectrum | Forensic Spectral Research |
| Technique | KBr0 |