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3-Methoxy-11-bromo-4,5-diphenyltricyclo[8.4.1.0(2,7)]pentadeca-1(14),2(7),3,5,8,10,12-heptaen-6-ol
SpectraBase Compound ID IIEguOFI42h
InChI InChI=1S/C28H21BrO2/c1-31-28-24-21-13-8-14-23(29)20(17-21)15-16-22(24)27(30)25(18-9-4-2-5-10-18)26(28)19-11-6-3-7-12-19/h2-16,30H,17H2,1H3
InChIKey GNXXEFXFMPWBKZ-UHFFFAOYSA-N
Mol Weight 469.38 g/mol
Molecular Formula C28H21BrO2
Exact Mass 468.072493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9sfJskUYVU8
Name 3-Methoxy-11-bromo-4,5-diphenyltricyclo[8.4.1.0(2,7)]pentadeca-1(14),2(7),3,5,8,10,12-heptaen-6-ol
Alternate Name(s) 11-bromo-3-methoxy-4,5-diphenyltricyclo[8.4.1.0(2,7)]pentadeca-1(14),2,4,6,8,10,12-heptaen-6-ol
Comments Less than 3 mono-isotopic peaks
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Formula C28H21BrO2
InChI InChI=1S/C28H21BrO2/c1-31-28-24-21-13-8-14-23(29)20(17-21)15-16-22(24)27(30)25(18-9-4-2-5-10-18)26(28)19-11-6-3-7-12-19/h2-16,30H,17H2,1H3
InChIKey GNXXEFXFMPWBKZ-UHFFFAOYSA-N
Molecular Weight 469.378 g/mol
SMILES Oc1c(c(-c2ccccc2)c(c2c1C=CC1=C(C=CC=C2C1)Br)OC)-c1ccccc1
SPLASH splash10-00ri-0005900000-c26bb20618fea0414382
Source of Spectrum H-77-2319-20
Wiley ID 1392448