SpectraBase Compound ID | 5R2bMamI7uB |
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InChI | InChI=1S/C26H34N2O4/c1-5-10-21(27-31-13-6-2)25-23(29)14-20(15-24(25)30)26(16-19-11-8-7-9-12-19)17-22(18(3)4)28-32-26/h6-9,11-12,18,20,29H,2,5,10,13-17H2,1,3-4H3/b27-21+ |
InChIKey | YKUPHXCIFSBEHM-SZXQPVLSSA-N |
Mol Weight | 438.6 g/mol |
Molecular Formula | C26H34N2O4 |
Exact Mass | 438.251858 g/mol |
SpectraBase Spectrum ID | BQ8sPjD8VBK |
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Name | 2-Cyclohexen-1-one, 5-[4,5-dihydro-3-(1-methylethyl)-5-(phenylmethyl)-5-isoxazolyl]-3-hydroxy-2-[1-[(2-propenyloxy)imino]butyl]- |
CAS Registry Number | 130113-82-5 |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C26H34N2O4 |
InChI | InChI=1S/C26H34N2O4/c1-5-10-21(27-31-13-6-2)25-23(29)14-20(15-24(25)30)26(16-19-11-8-7-9-12-19)17-22(18(3)4)28-32-26/h6-9,11-12,18,20,29H,2,5,10,13-17H2,1,3-4H3/b27-21+ |
InChIKey | YKUPHXCIFSBEHM-SZXQPVLSSA-N |
Instrument Name | Bruker IFS 85 |
Purity | slightly contaminated |
Technique | Film |