| SpectraBase Spectrum ID |
LRLu1KqHE9B |
| Name |
cis-threo-Davanafuran |
| CAS Registry Number |
56586-07-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H20O2 |
| 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/C14H20O2/c1-5-14(4)9-8-13(16-14)11(3)12-7-6-10(2)15-12/h5-7,11,13H,1,8-9H2,2-4H3/t11-,13+,14+/m1/s1 |
| InChIKey |
RZQBBGYIEUNQIV-XBFCOCLRSA-N |
| Molecular Weight |
220.312 g/mol |
| SMILES |
C1C[C@@](O[C@@]1(C)C=C)([H])[C@](C)(c1oc(cc1)C)[H] |
| SPLASH |
splash10-0a4l-9700000000-7f8e620cbad34549e717 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Synonyms |
Davanafuran |
| Wiley ID |
1886215 |
