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1-[5-acetyl-6-benzo[1,3]dioxol-5-yl-4-hydroxy-2-(4-methoxy-phenylamino)-4-methyl-cyclohex-1-enyl]-ethanone
SpectraBase Compound ID JyNZNJAdpTy
InChI InChI=1S/C25H27NO6/c1-14(27)22-19(26-17-6-8-18(30-4)9-7-17)12-25(3,29)24(15(2)28)23(22)16-5-10-20-21(11-16)32-13-31-20/h5-11,23-24,26,29H,12-13H2,1-4H3
InChIKey DXWPMPKRONMHRN-UHFFFAOYSA-N
Mol Weight 437.49 g/mol
Molecular Formula C25H27NO6
Exact Mass 437.183838 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FdICBU8HcCd
Name 1-[5-acetyl-6-benzo[1,3]dioxol-5-yl-4-hydroxy-2-(4-methoxy-phenylamino)-4-methyl-cyclohex-1-enyl]-ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H27NO6
InChI InChI=1S/C25H27NO6/c1-14(27)22-19(26-17-6-8-18(30-4)9-7-17)12-25(3,29)24(15(2)28)23(22)16-5-10-20-21(11-16)32-13-31-20/h5-11,23-24,26,29H,12-13H2,1-4H3
InChIKey DXWPMPKRONMHRN-UHFFFAOYSA-N
Molecular Weight 437.492 g/mol
SMILES OC1(C(C(C(=C(C1)Nc1ccc(cc1)OC)C(=O)C)c1cc2OCOc2cc1)C(=O)C)C
SPLASH splash10-000f-1449100000-f7e4eeeb8d5dc5e0f963
Synonyms 1-[2-(1,3-benzodioxol-5-yl)-3-ethanoyl-4-[(4-methoxyphenyl)amino]-6-methyl-6-oxidanyl-cyclohex-3-en-1-yl]ethanone 1-[3-acetyl-2-(1,3-benzodioxol-5-yl)-6-hydroxy-4-(4-methoxyanilino)-6-methyl-1-cyclohex-3-enyl]ethanone 1-[3-acetyl-2-(1,3-benzodioxol-5-yl)-6-hydroxy-4-(4-methoxyanilino)-6-methyl-cyclohex-3-en-1-yl]ethanone 1-[3-acetyl-2-(1,3-benzodioxol-5-yl)-6-hydroxy-6-methyl-4-(p-anisidino)cyclohex-3-en-1-yl]ethanone
Wiley ID 1454515