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Isopropyl 3-Hydroxy-7-bromo-9-phenyl-1-methyl-9,10-dihydro-phenanthrene-4-carboxylate
SpectraBase Compound ID Lg5bCwA1Nzq
InChI InChI=1S/C25H23BrO3/c1-14(2)29-25(28)24-22(27)11-15(3)19-13-20(16-7-5-4-6-8-16)21-12-17(26)9-10-18(21)23(19)24/h4-12,14,20,27H,13H2,1-3H3
InChIKey BZHUOJVCCQOBSV-UHFFFAOYSA-N
Mol Weight 451.36 g/mol
Molecular Formula C25H23BrO3
Exact Mass 450.083058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5p0EE4xNsBc
Name Isopropyl 3-Hydroxy-7-bromo-9-phenyl-1-methyl-9,10-dihydro-phenanthrene-4-carboxylate
Alternate Name(s) 7-Bromo-3-hydroxy-1-methyl-9-phenyl-9,10-dihydrophenanthrene-4-carboxylic acid propan-2-yl ester Propan-2-yl 7-bromo-3-hydroxy-1-methyl-9-phenyl-9,10-dihydrophenanthrene-4-carboxylate isopropyl 7-bromo-3-hydroxy-1-methyl-9-phenyl-9,10-dihydrophenanthrene-4-carboxylate Propan-2-yl 7-bromanyl-1-methyl-3-oxidanyl-9-phenyl-9,10-dihydrophenanthrene-4-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H23BrO3
InChI InChI=1S/C25H23BrO3/c1-14(2)29-25(28)24-22(27)11-15(3)19-13-20(16-7-5-4-6-8-16)21-12-17(26)9-10-18(21)23(19)24/h4-12,14,20,27H,13H2,1-3H3
InChIKey BZHUOJVCCQOBSV-UHFFFAOYSA-N
Molecular Weight 451.360 g/mol
SMILES Oc1c(c2-c3c(cc(cc3)Br)C(Cc2c(c1)C)c1ccccc1)C(OC(C)C)=O
SPLASH splash10-0006-0049400000-01ccdca486354add08ef
Source of Spectrum U1-2010-5125-5p
Wiley ID 1664401