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1-[(3a'RS,5a'RS,6'SR,6a'SR,6b'SR)-6'-Bromo-2,2'-dimethyl-3a'H-hexahydrocyclopropa[e][1,3]benzodioxol-6'-yl}-3-(3'',4'',5''-trimethoxyphenyl)propan-1-one
SpectraBase Compound ID 7b4rZW96g8Y
InChI InChI=1S/C22H29BrO6/c1-21(2)28-14-8-7-13-18(20(14)29-21)22(13,23)17(24)9-6-12-10-15(25-3)19(27-5)16(11-12)26-4/h10-11,13-14,18,20H,6-9H2,1-5H3
InChIKey XIMOQXXZGOTFSD-UHFFFAOYSA-N
Mol Weight 469.37 g/mol
Molecular Formula C22H29BrO6
Exact Mass 468.114752 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2D7Ov6GQ1Zc
Name 1-[(3a'RS,5a'RS,6'SR,6a'SR,6b'SR)-6'-Bromo-2,2'-dimethyl-3a'H-hexahydrocyclopropa[e][1,3]benzodioxol-6'-yl}-3-(3'',4'',5''-trimethoxyphenyl)propan-1-one
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Formula C22H29BrO6
InChI InChI=1S/C22H29BrO6/c1-21(2)28-14-8-7-13-18(20(14)29-21)22(13,23)17(24)9-6-12-10-15(25-3)19(27-5)16(11-12)26-4/h10-11,13-14,18,20H,6-9H2,1-5H3
InChIKey XIMOQXXZGOTFSD-UHFFFAOYSA-N
Molecular Weight 469.372 g/mol
SMILES C1(C2C3OC(C)(C)OC3CCC12)(C(=O)CCc1cc(OC)c(c(c1)OC)OC)Br
SPLASH splash10-001i-0900200000-63aa7fea9892be722410
Source of Spectrum KC-0-2827-32
Wiley ID 780047