| SpectraBase Compound ID | HWtMB5sDbFx |
|---|---|
| InChI | InChI=1S/C15H16O4/c1-7(2)12-9-4-8(3)5-11(17)13(9)10(6-16)14(18)15(12)19/h4-7,17-19H,1-3H3 |
| InChIKey | WWHRTLINNBKCGL-UHFFFAOYSA-N |
| Mol Weight | 260.29 g/mol |
| Molecular Formula | C15H16O4 |
| Exact Mass | 260.104859 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CuKARUlLxKE |
|---|---|
| Name | Hemigossypol |
| CAS Registry Number | 40817-07-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H16O4 |
| InChI | InChI=1S/C15H16O4/c1-7(2)12-9-4-8(3)5-11(17)13(9)10(6-16)14(18)15(12)19/h4-7,17-19H,1-3H3 |
| InChIKey | WWHRTLINNBKCGL-UHFFFAOYSA-N |
| Molecular Weight | 260.289 g/mol |
| SMILES | Oc1cc(cc2c1c(c(c(c2C(C)C)O)O)C=O)C |
| SPLASH | splash10-03fr-0490000000-2e948fc263de30917970 |
| Source of Spectrum | W5-1989-25078-1 |
| Synonyms | 2,3,8-Trihydroxy-4-isopropyl-6-methyl-1-naphthaldehyde 1-Naphthalenecarboxaldehyde, 2,3,8-trihydroxy-6-methyl-4-(1-methylethyl)- 2,3,8-trihydroxy-4-isopropyl-6-methyl-naphthalene-1-carbaldehyde 2,3,8-Trihydroxy-6-methyl-4-(1-methylethyl)-1-naphthalenecarboxaldehyde 2,3,8-trihydroxy-6-methyl-4-propan-2-yl-1-naphthalenecarboxaldehyde 2,3,8-trihydroxy-6-methyl-4-propan-2-ylnaphthalene-1-carbaldehyde 6-Methyl-2,3,8-tris(oxidanyl)-4-propan-2-yl-naphthalene-1-carbaldehyde |
| Wiley ID | 1263786 |