| SpectraBase Spectrum ID |
LI8jystJLmv |
| Name |
(2R,5R,6R,7S)-Germacra-1(10)E,4(15)-dien-5-hydroperoxy-2,6-diol-2-acetate |
| Appearance |
Colorless amorphous solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H28O5 |
| InChI |
InChI=1S/C17H28O5/c1-10(2)15-7-6-11(3)8-14(21-13(5)18)9-12(4)17(22-20)16(15)19/h8,10,14-17,19-20H,4,6-7,9H2,1-3,5H3/b11-8+/t14-,15-,16+,17+/m0/s1 |
| InChIKey |
YOWABXYMBGIQEY-ISFSCYEMSA-N |
| Instrument Name |
FISONS VG Prospec |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np050120q |
| Molecular Weight |
312.406 g/mol |
| Optical Rotation |
[a]D25 = -8.1 (c = 0.03, CHCl3) |
| Reported Formula |
C17H28O5 |
| SMILES |
OO[C@@]1(C(C[C@](\C=C\(CC[C@]([C@]1(O)[H])(C(C)C)[H])C)(OC(C)=O)[H])=C)[H] |
| SPLASH |
splash10-0002-9091000000-c4c14063e8c6be15b83c |
| Source of Spectrum |
G4-68-856-3 |
| Wiley ID |
1882025 |
