| SpectraBase Compound ID | CJUOtC7eGAE |
|---|---|
| InChI | InChI=1S/C26H32N2O4/c29-23(27-17-7-18-27)13-15-25(31,21-9-3-1-4-10-21)26(32,22-11-5-2-6-12-22)16-14-24(30)28-19-8-20-28/h1-6,9-12,31-32H,7-8,13-20H2/t25-,26-/m0/s1 |
| InChIKey | MOFVGPQSJYZUEE-UIOOFZCWSA-N |
| Mol Weight | 436.6 g/mol |
| Molecular Formula | C26H32N2O4 |
| Exact Mass | 436.236208 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | I5YGEnnqY4M |
|---|---|
| Name | (+-)-1,8-Di(azetidin-1-yl)-4,5-dihydroxy-4,5-diphenyloctane-1,8-dione |
| Alternate Name(s) | (4S,5S)-1,8-Bis-azetidin-1-yl-4,5-dihydroxy-4,5-diphenyl-octane-1,8-dione 1,8-Di(1-azetidinyl)-1,8-dioxo-4,5-diphenyl-4,5-octanediol (4S,5S)-1,8-bis(1-azetidinyl)-4,5-dihydroxy-4,5-diphenyloctane-1,8-dione (4S,5S)-1,8-bis(azetidin-1-yl)-4,5-dihydroxy-4,5-diphenyloctane-1,8-dione (4S,5S)-1,8-bis(azetidin-1-yl)-4,5-bis(oxidanyl)-4,5-diphenyl-octane-1,8-dione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C26H32N2O4 |
| InChI | InChI=1S/C26H32N2O4/c29-23(27-17-7-18-27)13-15-25(31,21-9-3-1-4-10-21)26(32,22-11-5-2-6-12-22)16-14-24(30)28-19-8-20-28/h1-6,9-12,31-32H,7-8,13-20H2/t25-,26-/m0/s1 |
| InChIKey | MOFVGPQSJYZUEE-UIOOFZCWSA-N |
| Molecular Weight | 436.552 g/mol |
| SMILES | O[C@@]([C@](CCC(N1CCC1)=O)(c1ccccc1)O)(CCC(N1CCC1)=O)c1ccccc1 |
| SPLASH | splash10-0bt9-9820000000-0c0682ffba219d66b0b4 |
| Source of Spectrum | KC-0-2033-3 |
| Wiley ID | 828423 |