![(2'S,3'S,1"S)-3-[3'-(2-Cyclohexenyl)-2'-(tert-butoxycarbonylamino)-3'-hydroxy]indole](/api/spectrum/6gfrNTpUjBw/structure.png?h=300&w=458 "(2'S,3'S,1\"S)-3-[3'-(2-Cyclohexenyl)-2'-(tert-butoxycarbonylamino)-3'-hydroxy]indole")
| SpectraBase Compound ID | 89daPU6iLd3 |
|---|---|
| InChI | InChI=1S/C22H30N2O3/c1-22(2,3)27-21(26)24-19(20(25)15-9-5-4-6-10-15)13-16-14-23-18-12-8-7-11-17(16)18/h5,7-9,11-12,14-15,19-20,23,25H,4,6,10,13H2,1-3H3,(H,24,26)/t15?,19-,20-/m0/s1 |
| InChIKey | PNOFBCMBHQINTR-FIRGRZAASA-N |
| Mol Weight | 370.49 g/mol |
| Molecular Formula | C22H30N2O3 |
| Exact Mass | 370.225643 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6gfrNTpUjBw |
|---|---|
| Name | (2'S,3'S,1"S)-3-[3'-(2-Cyclohexenyl)-2'-(tert-butoxycarbonylamino)-3'-hydroxy]indole |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H30N2O3 |
| InChI | InChI=1S/C22H30N2O3/c1-22(2,3)27-21(26)24-19(20(25)15-9-5-4-6-10-15)13-16-14-23-18-12-8-7-11-17(16)18/h5,7-9,11-12,14-15,19-20,23,25H,4,6,10,13H2,1-3H3,(H,24,26)/t15?,19-,20-/m0/s1 |
| InChIKey | PNOFBCMBHQINTR-FIRGRZAASA-N |
| Molecular Weight | 370.493 g/mol |
| SMILES | [nH]1c2c(c(C[C@@]([C@](C3C=CCCC3)(O)[H])(NC(OC(C)(C)C)=O)[H])c1)cccc2 |
| SPLASH | splash10-0a4i-9020000000-c734815df1f2cd189f25 |
| Source of Spectrum | F-52-7388-39 |
| Synonyms | (2'S,3'S,1''S)-3-[3'-(2-Cyclohexenyl)-2'-(tert-butoxycarbonylamino)-3'-hydroxy]indole |
| Wiley ID | 796843 |