![(2R)-methyl 2-(tert-butoxycarbonylamino)-3-(4-(2-(3,4-dihydro-2H-benzo[g]chromen-2-yloxy)ethoxy)phenyl)propanoate](/api/spectrum/3SGfNRJPioo/structure.png?h=300&w=458 "(2R)-methyl 2-(tert-butoxycarbonylamino)-3-(4-(2-(3,4-dihydro-2H-benzo[g]chromen-2-yloxy)ethoxy)phenyl)propanoate")
| SpectraBase Compound ID | G2CD8jsS5GY |
|---|---|
| InChI | InChI=1S/C30H35NO7/c1-30(2,3)38-29(33)31-25(28(32)34-4)17-20-9-12-24(13-10-20)35-15-16-36-27-14-11-23-18-21-7-5-6-8-22(21)19-26(23)37-27/h5-10,12-13,18-19,25,27H,11,14-17H2,1-4H3,(H,31,33)/t25-,27?/m1/s1 |
| InChIKey | YEGZXBHFWQXXLI-CSMDKSQMSA-N |
| Mol Weight | 521.6 g/mol |
| Molecular Formula | C30H35NO7 |
| Exact Mass | 521.241352 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3SGfNRJPioo |
|---|---|
| Name | (2R)-methyl 2-(tert-butoxycarbonylamino)-3-(4-(2-(3,4-dihydro-2H-benzo[g]chromen-2-yloxy)ethoxy)phenyl)propanoate |
| Appearance | Colorless oil |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H35NO7 |
| InChI | InChI=1S/C30H35NO7/c1-30(2,3)38-29(33)31-25(28(32)34-4)17-20-9-12-24(13-10-20)35-15-16-36-27-14-11-23-18-21-7-5-6-8-22(21)19-26(23)37-27/h5-10,12-13,18-19,25,27H,11,14-17H2,1-4H3,(H,31,33)/t25-,27?/m1/s1 |
| InChIKey | YEGZXBHFWQXXLI-CSMDKSQMSA-N |
| Instrument Name | GCMS |
| Ionization Type | EI |
| Molecular Weight | 521.610 g/mol |
| Reported Formula | C30H35NO7 |
| SMILES | N([C@](Cc1ccc(OCCOC2CCc3cc4ccccc4cc3O2)cc1)(C(=O)OC)[H])C(OC(C)(C)C)=O |
| SPLASH | splash10-003r-0943200000-32175bf785fa44059095 |
| Source of Spectrum | US20110108411A1 |
| Wiley ID | 1861818 |