| SpectraBase Spectrum ID |
CP1nq2OFFZm |
| Name |
2,2,5,7.8-Pentamethyl-8a-[(2',4'-dimethyl-1'-nitrilopent-2'-yl)dioxy]-2,3,4,6-tetrahydrobenzopyran-6-one |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H31NO4 |
| InChI |
InChI=1S/C21H31NO4/c1-8-9-13(2)18(12-22)24-26-21-16(5)14(3)19(23)15(4)17(21)10-11-20(6,7)25-21/h13,18H,8-11H2,1-7H3 |
| InChIKey |
AVBLLRHCLOXUGE-UHFFFAOYSA-N |
| Molecular Weight |
361.482 g/mol |
| SMILES |
C12(C(=C(C(=O)C(=C2C)C)C)CCC(O1)(C)C)OOC(C#N)C(CCC)C |
| SPLASH |
splash10-014i-0091000000-5d22fa11e70192ccb2ce |
| Source of Spectrum |
CRT-6-352-3b-2 |
| Synonyms |
3-Methyl-2-(2,2,5,7,8-pentamethyl-6-oxo-2,3,4,6-tetrahydro-chromen-8a-ylperoxy)-hexanenitrile |
| Wiley ID |
1715143 |
![2,2,5,7.8-Pentamethyl-8a-[(2',4'-dimethyl-1'-nitrilopent-2'-yl)dioxy]-2,3,4,6-tetrahydrobenzopyran-6-one](/api/spectrum/CP1nq2OFFZm/structure.png?h=300&w=458 "2,2,5,7.8-Pentamethyl-8a-[(2',4'-dimethyl-1'-nitrilopent-2'-yl)dioxy]-2,3,4,6-tetrahydrobenzopyran-6-one")
