| SpectraBase Compound ID | 1B1oaE0h4RJ |
|---|---|
| InChI | InChI=1S/C29H37NO4/c1-18-7-6-8-26-28(18,3)12-11-19(2)29(26,4)16-21-14-22(31)15-23(27(21)33)30-17-20-9-10-24(32)25(13-20)34-5/h7,9-10,13-15,19,26,30,32H,6,8,11-12,16-17H2,1-5H3/t19-,26+,28+,29+/m0/s1 |
| InChIKey | JGAMOGNEYSYZLF-OKOJKLGOSA-N |
| Mol Weight | 463.6 g/mol |
| Molecular Formula | C29H37NO4 |
| Exact Mass | 463.272259 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2PlpZJRAyO |
|---|---|
| Name | 3'-vanillylaminoavarone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H37NO4 |
| InChI | InChI=1S/C29H37NO4/c1-18-7-6-8-26-28(18,3)12-11-19(2)29(26,4)16-21-14-22(31)15-23(27(21)33)30-17-20-9-10-24(32)25(13-20)34-5/h7,9-10,13-15,19,26,30,32H,6,8,11-12,16-17H2,1-5H3/t19-,26+,28+,29+/m0/s1 |
| InChIKey | JGAMOGNEYSYZLF-OKOJKLGOSA-N |
| Instrument Name | JEOL JMSD-300 |
| Ionization Type | EI |
| Literature Reference DOI | 10.1021/np049873n |
| Molecular Weight | 463.618 g/mol |
| Reported Formula | C29H37NO4 |
| SMILES | N(C1=CC(C=C(C[C@@]2([C@](CC[C@]3([C@]2(CCC=C3C)[H])C)(C)[H])C)C1=O)=O)Cc1cc(c(cc1)O)OC |
| SPLASH | splash10-000i-0910000000-bd772a004ff641ce1c17 |
| Source of Spectrum | G4-67-1462-9 |
| Wiley ID | 1884070 |