| SpectraBase Spectrum ID |
LR5e9VQ1N5g |
| Name |
2-[4(a)-Formylcyclohex-(e)-yl]-3,5,6-trimethyl)-1,4-benzoquinone |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H20O3 |
| InChI |
InChI=1S/C16H20O3/c1-9-10(2)16(19)14(11(3)15(9)18)13-6-4-5-12(7-13)8-17/h8,12-13H,4-7H2,1-3H3/t12-,13?/m0/s1 |
| InChIKey |
CIQVLDHILPKCBH-UEWDXFNNSA-N |
| Molecular Weight |
260.333 g/mol |
| SMILES |
C1(=C(C(=O)C(=C(C1=O)C)C)C)C1C[C@@](C=O)(CCC1)[H] |
| SPLASH |
splash10-03di-0090000000-4b8f866b2d110458e569 |
| Source of Spectrum |
J-62-8676-29 |
| Synonyms |
(1S)-3-(2,4,5-trimethyl-3,6-dioxo-1,4-cyclohexadien-1-yl)cyclohexanecarbaldehyde |
| Wiley ID |
1264068 |
![2-[4(a)-Formylcyclohex-(e)-yl]-3,5,6-trimethyl)-1,4-benzoquinone](/api/spectrum/LR5e9VQ1N5g/structure.png?h=300&w=458 "2-[4(a)-Formylcyclohex-(e)-yl]-3,5,6-trimethyl)-1,4-benzoquinone")
