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2-[(5R,7R,8S)-6,6-dimethyl-9-oxo-6,7,8,9-tetrahydro-5H-5,8-epoxybenzo[7]annulen-7-yl]acetaldehyde
SpectraBase Compound ID 3CZJM61lV2p
InChI InChI=1S/C15H16O3/c1-15(2)11(7-8-16)13-12(17)9-5-3-4-6-10(9)14(15)18-13/h3-6,8,11,13-14H,7H2,1-2H3/t11-,13+,14+/m0/s1
InChIKey JLXUNHRSHYNDDV-IACUBPJLSA-N
Mol Weight 244.29 g/mol
Molecular Formula C15H16O3
Exact Mass 244.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BrEFLOPU4Vx
Name 2-[(5R,7R,8S)-6,6-dimethyl-9-oxo-6,7,8,9-tetrahydro-5H-5,8-epoxybenzo[7]annulen-7-yl]acetaldehyde
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Formula C15H16O3
InChI InChI=1S/C15H16O3/c1-15(2)11(7-8-16)13-12(17)9-5-3-4-6-10(9)14(15)18-13/h3-6,8,11,13-14H,7H2,1-2H3/t11-,13+,14+/m0/s1
InChIKey JLXUNHRSHYNDDV-IACUBPJLSA-N
Literature Reference DOI 10.1002/anie.201410723
Molecular Weight 244.290 g/mol
SMILES C1([C@]([C@@]2(C(c3c([C@]1(O2)[H])cccc3)=O)[H])(CC=O)[H])(C)C
SPLASH splash10-00kb-3900000000-1386f51b2f7250ce6b89
Source of Spectrum ACI-54-3043/SM20-4o
Synonyms 2-((5S,7R,8R)-6,6-dimethyl-9-oxo-6,7,8,9-tetrahydro-5H-5,8-epoxybenzo[7]annulen-7-yl)acetaldehyde
Wiley ID 1760440