| SpectraBase Spectrum ID |
37nhqjZA6S |
| Name |
Ionol acetate<(E)-alpha-isomethyl-> |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
250.193280075 u |
| Formula |
C16H26O2 |
| GC Column |
J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness) |
| GC Oven Program |
60 °C to 246 °C at 3 °C/min. |
| InChI |
InChI=1S/C16H26O2/c1-11-8-7-9-16(5,6)15(11)10-12(2)13(3)18-14(4)17/h8,10,13,15H,7,9H2,1-6H3/b12-10- |
| InChIKey |
TYUPZTIJMKMYHL-BENRWUELSA-N |
| Molecular Weight |
250.382 g/mol |
| Nominal Mass |
250 u |
| Number of Peaks |
115 |
| SMILES |
C(=O)(C)OC(\C(=C/C1C(=CCCC1(C)C)C)C)C |
| SPLASH |
splash10-0006-8900000000-fd0edcf1aae4e5fedfac |
| Source |
ex BEDOUKAIN RES. |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000711 |
