| SpectraBase Spectrum ID |
KGhVkbI0Vx1 |
| Name |
Davanol D1(isomer 1) |
| 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 |
238.193280075 u |
| Formula |
C15H26O2 |
| 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/C15H26O2/c1-6-15(5)10-9-14(17-15)12(4)13(16)8-7-11(2)3/h6-7,12-14,16H,1,8-10H2,2-5H3/t12?,13-,14+,15+/m1/s1 |
| InChIKey |
XDDCIEBLDYBJNU-LQFPDLAYSA-N |
| Molecular Weight |
238.371 g/mol |
| Nominal Mass |
238 u |
| Number of Peaks |
168 |
| SMILES |
O[C@@](C(C)[C@@]1(CC[C@@](O1)(C=C)C)[H])(CC=C(C)C)[H] |
| SPLASH |
splash10-0006-9200000000-62d73241c082f8bed8c1 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000456 |
