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(9R,10R,12S)-12-bromo-9-(pent-4-en-1-yl)-9,10-dihydro-9,10-ethanoanthracene-12-carbaldehyde
SpectraBase Compound ID 62KxMYQLXGF
InChI InChI=1S/C22H21BrO/c1-2-3-8-13-22-19-11-6-4-9-16(19)18(14-21(22,23)15-24)17-10-5-7-12-20(17)22/h2,4-7,9-12,15,18H,1,3,8,13-14H2/t18-,21-,22+/m1/s1
InChIKey IPYDTMOVPLZKSK-QIJUGHKUSA-N
Mol Weight 381.31 g/mol
Molecular Formula C22H21BrO
Exact Mass 380.077578 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8y51CVdhu6w
Name (9R,10R,12S)-12-bromo-9-(pent-4-en-1-yl)-9,10-dihydro-9,10-ethanoanthracene-12-carbaldehyde
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Formula C22H21BrO
InChI InChI=1S/C22H21BrO/c1-2-3-8-13-22-19-11-6-4-9-16(19)18(14-21(22,23)15-24)17-10-5-7-12-20(17)22/h2,4-7,9-12,15,18H,1,3,8,13-14H2/t18-,21-,22+/m1/s1
InChIKey IPYDTMOVPLZKSK-QIJUGHKUSA-N
Literature Reference DOI 10.1016/j.jscs.2013.03.001
Molecular Weight 381.313 g/mol
SMILES c1ccc2c(c1)[C@]1(c3ccccc3[C@@]2([C@@](C1)(C=O)Br)CCCC=C)[H]
SPLASH splash10-014i-2791000000-59c7f38647dddc6173df
Source of Spectrum Adel Al-Saeedi, et al. Journal ofSaudi Chemical Society, 10.1016/j.jscs.2013.03.001
Wiley ID 1817060