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8a-Methyl-4-phenyl-8-(.alpha.-hydroxy-4-chlorobenzyl)-4,4a,5,6,7,8-hexahydro-8aH-benzo[b]pyran
SpectraBase Compound ID SaIOvAVtb1
InChI InChI=1S/C23H25ClO2/c1-23-20(19(14-15-26-23)16-6-3-2-4-7-16)8-5-9-21(23)22(25)17-10-12-18(24)13-11-17/h2-4,6-7,10-15,19-22,25H,5,8-9H2,1H3/t19-,20-,21-,22-,23+/m0/s1
InChIKey KGDFDDKCOYRDGG-XZCBWCRCSA-N
Mol Weight 368.9 g/mol
Molecular Formula C23H25ClO2
Exact Mass 368.154308 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L65gf3cYe7n
Name 8a-Methyl-4-phenyl-8-(.alpha.-hydroxy-4-chlorobenzyl)-4,4a,5,6,7,8-hexahydro-8aH-benzo[b]pyran
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H25ClO2
InChI InChI=1S/C23H25ClO2/c1-23-20(19(14-15-26-23)16-6-3-2-4-7-16)8-5-9-21(23)22(25)17-10-12-18(24)13-11-17/h2-4,6-7,10-15,19-22,25H,5,8-9H2,1H3/t19-,20-,21-,22-,23+/m0/s1
InChIKey KGDFDDKCOYRDGG-XZCBWCRCSA-N
Molecular Weight 368.904 g/mol
SMILES O[C@]([C@]1([C@]2([C@]([C@](c3ccccc3)(C=CO2)[H])(CCC1)[H])C)[H])(c1ccc(cc1)Cl)[H]
SPLASH splash10-001l-6912000000-c2f242d90a6833020d32
Source of Spectrum QE-1-236-12
Synonyms (8a-methyl-4-phenyl-4a,5,6,7,8,8a-hexahydro-4H-chromen-8-yl)(4-chlorophenyl)methanol (R)-(4-Chloro-phenyl)-((4R,4aS,8S,8aR)-8a-methyl-4-phenyl-4a,5,6,7,8,8a-hexahydro-4H-chromen-8-yl)-methanol (R)-[(4R,4aS,8S,8aR)-8a-methyl-4-phenyl-4,4a,5,6,7,8-hexahydro-1-benzopyran-8-yl]-(4-chlorophenyl)methanol
Wiley ID 842467