![2-[(Heptaprenyl)methyl]-2-methyl-6-hydroxybenzopyran](/api/spectrum/2CQ7PZriIZD/structure.png?h=300&w=458 "2-[(Heptaprenyl)methyl]-2-methyl-6-hydroxybenzopyran")
| SpectraBase Compound ID | H5CdN8LKycB |
|---|---|
| InChI | InChI=1S/C46H68O2/c1-36(2)17-10-18-37(3)19-11-20-38(4)21-12-22-39(5)23-13-24-40(6)25-14-26-41(7)27-15-28-42(8)29-16-33-46(9)34-32-43-35-44(47)30-31-45(43)48-46/h17,19,21,23,25,27,29-32,34-35,47H,10-16,18,20,22,24,26,28,33H2,1-9H3/b37-19+,38-21+,39-23+,40-25+,41-27+,42-29+ |
| InChIKey | DMKVBXNOBTZPRF-CJMZPWCUSA-N |
| Mol Weight | 653.0 g/mol |
| Molecular Formula | C46H68O2 |
| Exact Mass | 652.521931 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2CQ7PZriIZD |
|---|---|
| Name | 2-[(Heptaprenyl)methyl]-2-methyl-6-hydroxybenzopyran |
| Alternate Name(s) | 2-[(3E,7E,11E,15E,19E,23E)-4,8,12,16,20,24,28-heptamethyl-3,7,11,15,19,23,27-nonacosaheptaenyl]-2-methyl-2H-chromen-6-ol 2-[(3E,7E,11E,15E,19E,23E)-4,8,12,16,20,24,28-heptamethylnonacosa-3,7,11,15,19,23,27-heptaenyl]-2-methyl-1-benzopyran-6-ol 2-[(3E,7E,11E,15E,19E,23E)-4,8,12,16,20,24,28-heptamethylnonacosa-3,7,11,15,19,23,27-heptaenyl]-2-methylchromen-6-ol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C46H68O2 |
| InChI | InChI=1S/C46H68O2/c1-36(2)17-10-18-37(3)19-11-20-38(4)21-12-22-39(5)23-13-24-40(6)25-14-26-41(7)27-15-28-42(8)29-16-33-46(9)34-32-43-35-44(47)30-31-45(43)48-46/h17,19,21,23,25,27,29-32,34-35,47H,10-16,18,20,22,24,26,28,33H2,1-9H3/b37-19+,38-21+,39-23+,40-25+,41-27+,42-29+ |
| InChIKey | DMKVBXNOBTZPRF-CJMZPWCUSA-N |
| Molecular Weight | 653.048 g/mol |
| SMILES | Oc1ccc2OC(C=Cc2c1)(CC\C=C\(CC\C=C\(CC\C=C\(CC\C=C\(CC\C=C\(CC\C=C\(CCC=C(C)C)C)C)C)C)C)C)C |
| SPLASH | splash10-03di-0910002000-c80092d8f24cdad25e4e |
| Source of Spectrum | G4-58-1453-9 |
| Wiley ID | 1606042 |