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1-((1S,4aR,9bS)-4-Hydroxy-1-phenyl-1,2,4a,9b-tetrahydro-dibenzofuran-3-yl)-butan-1-one
SpectraBase Compound ID Bziqjl8YqcH
InChI InChI=1S/C22H22O3/c1-2-8-18(23)17-13-16(14-9-4-3-5-10-14)20-15-11-6-7-12-19(15)25-22(20)21(17)24/h3-7,9-12,16,20,22,24H,2,8,13H2,1H3/t16-,20-,22-/m1/s1
InChIKey QBAWQXYBRVEWCU-BSLALVQMSA-N
Mol Weight 334.42 g/mol
Molecular Formula C22H22O3
Exact Mass 334.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AQrPkAelrUm
Name 1-((1S,4aR,9bS)-4-Hydroxy-1-phenyl-1,2,4a,9b-tetrahydro-dibenzofuran-3-yl)-butan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22O3
InChI InChI=1S/C22H22O3/c1-2-8-18(23)17-13-16(14-9-4-3-5-10-14)20-15-11-6-7-12-19(15)25-22(20)21(17)24/h3-7,9-12,16,20,22,24H,2,8,13H2,1H3/t16-,20-,22-/m1/s1
InChIKey QBAWQXYBRVEWCU-BSLALVQMSA-N
Molecular Weight 334.415 g/mol
SMILES OC=1[C@@]2(Oc3ccccc3[C@@]2([C@](CC1C(=O)CCC)(c1ccccc1)[H])[H])[H]
SPLASH splash10-0fk9-9804000000-a0c874c070a857fdf7ee
Source of Spectrum F5-3-2302-11j
Synonyms 1-[(1R,4aS,9bR)-1',2',4'a,9'b-Tetrahydro-4'-hydroxy-1'-phenyl-3'-dibenzofuranyl]-1-butanone 1-((1S,4aR,9bS)-4-hydroxy-1-phenyl-1,2,4a,9b-tetrahydrodibenzo[b,d]furan-3-yl)butan-1-one 1-[(1S,4aR,9bS)-4-hydroxy-1-phenyl-1,2,4a,9b-tetrahydrodibenzofuran-3-yl]-1-butanone 1-[(1S,4aR,9bS)-4-oxidanyl-1-phenyl-1,2,4a,9b-tetrahydrodibenzofuran-3-yl]butan-1-one
Wiley ID 1732356