| SpectraBase Spectrum ID |
8Hmh87a9sAa |
| Name |
Griseofulvin |
| CAS Registry Number |
126-07-8 |
| Classification |
Pharmaceutical drug, antifungal, antimycotic |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
352.071365961 u |
| Formula |
C17H17ClO6 |
| InChI |
InChI=1S/C17H17ClO6/c1-8-5-9(19)6-12(23-4)17(8)16(20)13-10(21-2)7-11(22-3)14(18)15(13)24-17/h6-8H,5H2,1-4H3 |
| InChIKey |
DDUHZTYCFQRHIY-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
352.770 g/mol |
| Nominal Mass |
352 u |
| Quality |
1000 |
| Retention Index |
2700 |
| SMILES |
C12(C(C=3C(O2)=C(C(=CC3OC)OC)Cl)=O)C(=CC(CC1C)=O)OC |
| SPLASH |
splash10-0hg9-4984000000-9db9d17c9dfd59e544ba |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
(2S,6'R)-7-Chloro-2',4,6-trimethoxy-6'-methylbenzofuran-2-spiro-1'-cyclohex-2'-ene-3,4'-dione |
| Technique |
GC/MS |
| Wiley ID |
DD2024_007543 |
![Spiro[benzofuran-2(3H),1'-[2]cyclohexene]-3,4'-dione, 7-chloro-2',4,6-trimethoxy-6'-methyl-, (1'S-trans)-](/api/spectrum/8Hmh87a9sAa/structure.png?h=300&w=458 "Spiro[benzofuran-2(3H),1'-[2]cyclohexene]-3,4'-dione, 7-chloro-2',4,6-trimethoxy-6'-methyl-, (1'S-trans)-")
