| SpectraBase Spectrum ID |
Iw6UOYNznJm |
| Name |
Melaleucol |
| CAS Registry Number |
21722-31-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H16O4 |
| GC Column |
J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness) |
| GC Oven Program |
60 ??C to 246 ??C at 3 ??C/min. |
| InChI |
InChI=1S/C12H16O4/c1-6-10(14)9(8(3)13)12(16-5)7(2)11(6)15-4/h14H,1-5H3 |
| InChIKey |
JBCWRYMDCRFOGV-UHFFFAOYSA-N |
| Molecular Weight |
224.256 g/mol |
| SMILES |
Oc1c(c(c(c(OC)c1C)C)OC)C(C)=O |
| SPLASH |
splash10-0a4i-9660000000-a17c65c41c554401aa7b |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
1886651 |
