![2,5-Cyclohexadiene-1,4-dione, 2,3,5-trimethyl-6-(3,7,11,15-tetramethyl-2-hexadecenyl)-, [R-[R*,R*-(E)]]-](/api/spectrum/HI6xl31G1Vh/structure.png?h=300&w=458 "2,5-Cyclohexadiene-1,4-dione, 2,3,5-trimethyl-6-(3,7,11,15-tetramethyl-2-hexadecenyl)-, [R-[R*,R*-(E)]]-")
| SpectraBase Compound ID | 8NHD483tfpi |
|---|---|
| InChI | InChI=1S/C29H48O2/c1-20(2)12-9-13-21(3)14-10-15-22(4)16-11-17-23(5)18-19-27-26(8)28(30)24(6)25(7)29(27)31/h18,20-22H,9-17,19H2,1-8H3/b23-18+/t21-,22-/m1/s1 |
| InChIKey | SJPDQAGAIQSHOW-MRIFWDATSA-N |
| Mol Weight | 428.7 g/mol |
| Molecular Formula | C29H48O2 |
| Exact Mass | 428.365431 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HI6xl31G1Vh |
|---|---|
| Name | 2,5-Cyclohexadiene-1,4-dione, 2,3,5-trimethyl-6-(3,7,11,15-tetramethyl-2-hexadecenyl)-, [R-[R*,R*-(E)]]- |
| CAS Registry Number | 28072-25-5 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H48O2 |
| InChI | InChI=1S/C29H48O2/c1-20(2)12-9-13-21(3)14-10-15-22(4)16-11-17-23(5)18-19-27-26(8)28(30)24(6)25(7)29(27)31/h18,20-22H,9-17,19H2,1-8H3/b23-18+/t21-,22-/m1/s1 |
| InChIKey | SJPDQAGAIQSHOW-MRIFWDATSA-N |
| Molecular Weight | 428.701 g/mol |
| SMILES | C1(=C(C(=O)C(=C(C1=O)C)C)C)C\C=C\(CCC[C@@](CCC[C@@](CCCC(C)C)(C)[H])(C)[H])C |
| SPLASH | splash10-002g-9110300000-fa58fe245a35630ec964 |
| Source of Spectrum | J-45-4104-0 |
| Synonyms | 2,3,5-trimethyl-6-[(2E,7R,11R)-3,7,11,15-tetramethyl-2-hexadecenyl]benzo-1,4-quinone p-Benzoquinone, 2,3,5-trimethyl-6-phytyl-, (E)- Trimethylphytylbenzoquinone 2,3,5-trimethyl-6-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]-1,4-benzoquinone 2,3,5-trimethyl-6-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]cyclohexa-2,5-diene-1,4-dione |
| Wiley ID | 1380942 |