| SpectraBase Spectrum ID |
HUTFlJqMVCP |
| Name |
Shyobunol |
| CAS Registry Number |
35727-45-8 |
| 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 |
222.198365456 u |
| Formula |
C15H26O |
| 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/C15H26O/c1-7-15(6)9-8-12(10(2)3)14(16)13(15)11(4)5/h7,10,12-14,16H,1,4,8-9H2,2-3,5-6H3/t12-,13+,14+,15+/m0/s1 |
| InChIKey |
WOULTTPZJDSDEI-GBJTYRQASA-N |
| Molecular Weight |
222.372 g/mol |
| Nominal Mass |
222 u |
| Number of Peaks |
128 |
| SMILES |
O[C@]1([C@]([C@@](C=C)(C)CC[C@]1(C(C)C)[H])(C(C)=C)[H])[H] |
| SPLASH |
splash10-001l-9400000000-1819d0a853649b2a862e |
| Source |
ex CHENOPODIUM SCHARDERANUM ex ART TUCKER |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA001264 |
