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1-{(1'RS,2'SR,3'RS,6'RS,7'SR)-7'-Bromo-2',3'-dihydroxybicyclo[4.1.0]heptan-7'-yl}-3-(3'',4'',5''-trimethoxyphenyl)propan-1-one

View entire compound with spectra: 1 MS (GC)

1-{(1'RS,2'SR,3'RS,6'RS,7'SR)-7'-Bromo-2',3'-dihydroxybicyclo[4.1.0]heptan-7'-yl}-3-(3'',4'',5''-trimethoxyphenyl)propan-1-one
SpectraBase Compound ID GcsuGllPnJX
InChI InChI=1S/C19H25BrO6/c1-24-13-8-10(9-14(25-2)18(13)26-3)4-7-15(22)19(20)11-5-6-12(21)17(23)16(11)19/h8-9,11-12,16-17,21,23H,4-7H2,1-3H3
InChIKey RNTNEUAAGAHMMQ-UHFFFAOYSA-N
Mol Weight 429.31 g/mol
Molecular Formula C19H25BrO6
Exact Mass 428.083452 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IvHeR8fXJK0
Name 1-{(1'RS,2'SR,3'RS,6'RS,7'SR)-7'-Bromo-2',3'-dihydroxybicyclo[4.1.0]heptan-7'-yl}-3-(3'',4'',5''-trimethoxyphenyl)propan-1-one
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Formula C19H25BrO6
InChI InChI=1S/C19H25BrO6/c1-24-13-8-10(9-14(25-2)18(13)26-3)4-7-15(22)19(20)11-5-6-12(21)17(23)16(11)19/h8-9,11-12,16-17,21,23H,4-7H2,1-3H3
InChIKey RNTNEUAAGAHMMQ-UHFFFAOYSA-N
Molecular Weight 429.307 g/mol
SMILES OC1CCC2C(C2C1O)(C(=O)CCc1cc(OC)c(c(c1)OC)OC)Br
SPLASH splash10-001i-0900000000-20cf949b172ab61a605f
Source of Spectrum KC-0-2827-33
Synonyms 1-(7-bromo-2,3-dihydroxybicyclo[4.1.0]hept-7-yl)-3-(3,4,5-trimethoxyphenyl)-1-propanone 1-{7'-Bromo-2',3'-dihydroxybicyclo[4.1.0]heptan-7'-yl}-3-(3'',4'',5''-trimethoxyphenyl)propan-1-one
Wiley ID 780046