| SpectraBase Spectrum ID |
CVGTOAfjdBf |
| Name |
7-Demethylsuberosin |
| Source of Sample |
Cayman Chemical Company |
| Catalog Number |
35282 |
| Lot Number |
0647575-2 |
| Accessory |
DurasamplIR II |
| CAS Registry Number |
21422-04-8 |
| Copyright |
Copyright © 2019-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
230.094294308 u |
| Formula |
C14H14O3 |
| InChI |
InChI=1S/C14H14O3/c1-9(2)3-4-10-7-11-5-6-14(16)17-13(11)8-12(10)15/h3,5-8,15H,4H2,1-2H3 |
| InChIKey |
FIDUIAPDSKSUGO-UHFFFAOYSA-N |
| Instrument Name |
Bio-Rad FTS |
| Molecular Weight |
230.263 g/mol |
| Purity |
≥98% |
| Resolution |
4 |
| SMILES |
C1(C=CC=2C(O1)=CC(=C(C2)CC=C(C)C)O)=O |
| Scan Speed (number) |
5 |
| Source of Spectrum |
Forensic Spectral Research |
| Synonyms |
7-hydroxy-6-(3-methyl-2-buten-1-yl)-2H-1-benzopyran-2-one
Demethylsuberosin |
| Technique |
ATR-Neat |
