| SpectraBase Spectrum ID |
EqMh6ySZYqH |
| Name |
3-Buten-2-one, 4-(1,2,4-trihydroxy-2,6,6-trimethylcyclohexyl)-, [1.alpha.,1(E),2.beta.,4.alpha.]- |
| CAS Registry Number |
127643-61-2 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H22O4 |
| InChI |
InChI=1S/C13H22O4/c1-9(14)5-6-13(17)11(2,3)7-10(15)8-12(13,4)16/h5-6,10,15-17H,7-8H2,1-4H3/b6-5+/t10-,12-,13-/m1/s1 |
| InChIKey |
QASOACWKTAXFSE-CEBQCFOOSA-N |
| Molecular Weight |
242.315 g/mol |
| SMILES |
O[C@]1(C[C@]([C@](C(C1)(C)C)(\C=C\C(=O)C)O)(O)C)[H] |
| SPLASH |
splash10-0006-9400000000-d7d8ff9fb33b9f9b99f0 |
| Source of Spectrum |
B-42-1803-7 |
| Synonyms |
(3E)-4-[(1R,2R,4R)-1,2,4-trihydroxy-2,6,6-trimethylcyclohexyl]-3-buten-2-one
(E)-4-R-1',t-2',c-4'-trihydroxy-3',6',6'-trimethylcyclohexyl)but-3-en-2-one
(E)-4-[(1R,2R,4R)-1,2,4-trihydroxy-2,6,6-trimethylcyclohexyl]-3-buten-2-one
(E)-4-[(1R,2R,4R)-1,2,4-trihydroxy-2,6,6-trimethylcyclohexyl]but-3-en-2-one
(E)-4-[(1R,4R,6R)-2,2,6-trimethyl-1,4,6-tris(oxidanyl)cyclohexyl]but-3-en-2-one |
| Wiley ID |
1244963 |
![3-Buten-2-one, 4-(1,2,4-trihydroxy-2,6,6-trimethylcyclohexyl)-, [1.alpha.,1(E),2.beta.,4.alpha.]-](/api/spectrum/EqMh6ySZYqH/structure.png?h=300&w=458 "3-Buten-2-one, 4-(1,2,4-trihydroxy-2,6,6-trimethylcyclohexyl)-, [1.alpha.,1(E),2.beta.,4.alpha.]-")
