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(2S,3S,4S)-3-Bromo-2,4-bis(methoxy)-2-(3'-methylphenyl)chromane
SpectraBase Compound ID ap0PhgceFC
InChI InChI=1S/C18H19BrO3/c1-12-7-6-8-13(11-12)18(21-3)17(19)16(20-2)14-9-4-5-10-15(14)22-18/h4-11,16-17H,1-3H3/t16-,17-,18-/m0/s1
InChIKey VINHHDSYYAWPNL-BZSNNMDCSA-N
Mol Weight 363.25 g/mol
Molecular Formula C18H19BrO3
Exact Mass 362.051757 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ERn7f51yr2V
Name (2S,3S,4S)-3-Bromo-2,4-bis(methoxy)-2-(3'-methylphenyl)chromane
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Formula C18H19BrO3
InChI InChI=1S/C18H19BrO3/c1-12-7-6-8-13(11-12)18(21-3)17(19)16(20-2)14-9-4-5-10-15(14)22-18/h4-11,16-17H,1-3H3/t16-,17-,18-/m0/s1
InChIKey VINHHDSYYAWPNL-BZSNNMDCSA-N
Molecular Weight 363.251 g/mol
SMILES [C@]1([C@]([C@@](OC)(c2c(O1)cccc2)[H])(Br)[H])(c1cc(C)ccc1)OC
SPLASH splash10-000i-0904000000-f611c50bf79ed770d14d
Source of Spectrum SK-26-3072-10
Synonyms (2S,3S,4S)-3-bromo-2,4-dimethoxy-2-(3-methylphenyl)-3,4-dihydro-2H-chromene 3-Bromo-2,4-bis(methoxy)-2-(3'-methylphenyl)chromane
Wiley ID 867229