![(2R)-methyl 2-(tert-butoxycarbonylamino)-3-(4-(4-(2-methoxy-3,4-dihydro-2H-benzo[g]chromen-3-yl)butoxy)phenyl)propanoate](/api/spectrum/GCP0qZtb1cI/structure.png?h=300&w=458 "(2R)-methyl 2-(tert-butoxycarbonylamino)-3-(4-(4-(2-methoxy-3,4-dihydro-2H-benzo[g]chromen-3-yl)butoxy)phenyl)propanoate")
| SpectraBase Compound ID | 5KvBYysrOpc |
|---|---|
| InChI | InChI=1S/C33H41NO7/c1-33(2,3)41-32(36)34-28(30(35)37-4)18-22-13-15-27(16-14-22)39-17-9-8-12-25-20-26-19-23-10-6-7-11-24(23)21-29(26)40-31(25)38-5/h6-7,10-11,13-16,19,21,25,28,31H,8-9,12,17-18,20H2,1-5H3,(H,34,36)/t25?,28-,31?/m1/s1 |
| InChIKey | GMAABYAXZLSSKI-DPPLCSQNSA-N |
| Mol Weight | 563.7 g/mol |
| Molecular Formula | C33H41NO7 |
| Exact Mass | 563.288303 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GCP0qZtb1cI |
|---|---|
| Name | (2R)-methyl 2-(tert-butoxycarbonylamino)-3-(4-(4-(2-methoxy-3,4-dihydro-2H-benzo[g]chromen-3-yl)butoxy)phenyl)propanoate |
| Appearance | Colorless oil |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C33H41NO7 |
| InChI | InChI=1S/C33H41NO7/c1-33(2,3)41-32(36)34-28(30(35)37-4)18-22-13-15-27(16-14-22)39-17-9-8-12-25-20-26-19-23-10-6-7-11-24(23)21-29(26)40-31(25)38-5/h6-7,10-11,13-16,19,21,25,28,31H,8-9,12,17-18,20H2,1-5H3,(H,34,36)/t25?,28-,31?/m1/s1 |
| InChIKey | GMAABYAXZLSSKI-DPPLCSQNSA-N |
| Instrument Name | GCMS |
| Ionization Type | EI |
| Molecular Weight | 563.691 g/mol |
| SMILES | N([C@](Cc1ccc(OCCCCC2Cc3cc4ccccc4cc3OC2OC)cc1)(C(=O)OC)[H])C(OC(C)(C)C)=O |
| SPLASH | splash10-0007-0619000000-b1c4f049875324e8b47c |
| Source of Spectrum | US20110108411A1 |
| Wiley ID | 1861819 |