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trans,cis,trans-4,11-diacetoxytricyclo[6.4.0.0(2,7)]dodeca-3,11-diene
SpectraBase Compound ID J7gnlSxqmUG
InChI InChI=1S/C16H20O4/c1-9(17)19-11-3-5-13-14-6-4-12(20-10(2)18)8-16(14)15(13)7-11/h7-8,13-16H,3-6H2,1-2H3/t13-,14+,15+,16-
InChIKey LBOAVYRHIKJISX-SYMSYNOKSA-N
Mol Weight 276.33 g/mol
Molecular Formula C16H20O4
Exact Mass 276.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C1GmIPeORB4
Name trans,cis,trans-4,11-diacetoxytricyclo[6.4.0.0(2,7)]dodeca-3,11-diene
CAS Registry Number 115018-86-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O4
InChI InChI=1S/C16H20O4/c1-9(17)19-11-3-5-13-14-6-4-12(20-10(2)18)8-16(14)15(13)7-11/h7-8,13-16H,3-6H2,1-2H3/t13-,14+,15+,16-
InChIKey LBOAVYRHIKJISX-SYMSYNOKSA-N
Molecular Weight 276.332 g/mol
SMILES [C@@]12([C@@]3(C=C(OC(=O)C)CC[C@]3([C@]2(CCC(=C1)OC(=O)C)[H])[H])[H])[H]
SPLASH splash10-0002-9200000000-e3cbf9eada5ff8d360ce
Source of Spectrum K-121-2002-11
Synonyms (4aR,4bS,8aR,8bS)-7-(acetyloxy)-3,4,4a,4b,5,6,8a,8b-octahydro-2-biphenylenyl acetate
Wiley ID 1280178