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2-[(5R,6R,7R,8S)-9-oxo-6-vinyl-6,7,8,9-tetrahydro-5H-5,8-epoxybenzo[7]annulen-7-yl]acetaldehyde
SpectraBase Compound ID 9LClTuvtuQR
InChI InChI=1S/C15H14O3/c1-2-9-12(7-8-16)15-13(17)10-5-3-4-6-11(10)14(9)18-15/h2-6,8-9,12,14-15H,1,7H2/t9-,12-,14+,15-/m1/s1
InChIKey HEXQTKRAARBRSM-QBXIECCESA-N
Mol Weight 242.27 g/mol
Molecular Formula C15H14O3
Exact Mass 242.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ANLM44GkfDe
Name 2-[(5R,6R,7R,8S)-9-oxo-6-vinyl-6,7,8,9-tetrahydro-5H-5,8-epoxybenzo[7]annulen-7-yl]acetaldehyde
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Formula C15H14O3
InChI InChI=1S/C15H14O3/c1-2-9-12(7-8-16)15-13(17)10-5-3-4-6-11(10)14(9)18-15/h2-6,8-9,12,14-15H,1,7H2/t9-,12-,14+,15-/m1/s1
InChIKey HEXQTKRAARBRSM-QBXIECCESA-N
Literature Reference DOI 10.1002/anie.201410723
Molecular Weight 242.274 g/mol
SMILES [C@@]1([C@]([C@]2(O[C@@]1(c1ccccc1C2=O)[H])[H])(CC=O)[H])(C=C)[H]
SPLASH splash10-00l2-1900000000-cc10ae1f22feb78e574c
Source of Spectrum ACI-54-3043/SM22-4q
Synonyms 2-((5S,6R,7R,8R)-9-oxo-6-vinyl-6,7,8,9-tetrahydro-5H-5,8-epoxybenzo[7]annulen-7-yl)acetaldehyde
Wiley ID 1760442