| SpectraBase Spectrum ID |
G0gMnXmVmCw |
| Name |
(4S)-3,5,5-trimethyl-4-oxidanyl-4-[(E,3R)-3-oxidanylbut-1-enyl]cyclohex-2-en-1-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H20O3 |
| InChI |
InChI=1S/C13H20O3/c1-9-7-11(15)8-12(3,4)13(9,16)6-5-10(2)14/h5-7,10,14,16H,8H2,1-4H3/b6-5+/t10-,13-/m1/s1 |
| InChIKey |
KPQMCAKZRXOZLB-KOIHBYQTSA-N |
| Molecular Weight |
224.300 g/mol |
| SMILES |
O[C@@](\C=C\[C@]1(C(=CC(CC1(C)C)=O)C)O)(C)[H] |
| SPLASH |
splash10-00di-0900000000-1d18939ad9d5d12a59e4 |
| Source of Spectrum |
QA-45-106-7 |
| Synonyms |
Blumenol A
(4S)-4-hydroxy-4-[(E,3R)-3-hydroxybut-1-enyl]-3,5,5-trimethyl-1-cyclohex-2-enone
(4S)-4-hydroxy-4-[(E,3R)-3-hydroxybut-1-enyl]-3,5,5-trimethyl-cyclohex-2-en-1-one |
| Wiley ID |
862777 |
