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(1R*,8S*,9R*,14S*)-10,13-Dibutyl-15-oxatetracyclo[6.6.1.0(2,7).0(9,14)]pentadeca-2,4,6,10,12-pentaene
SpectraBase Compound ID 7QL2D69A2nK
InChI InChI=1S/C22H28O/c1-3-5-9-15-13-14-16(10-6-4-2)20-19(15)21-17-11-7-8-12-18(17)22(20)23-21/h7-8,11-14,19-22H,3-6,9-10H2,1-2H3/t19-,20+,21+,22-
InChIKey QRIFQKZHXDVCBJ-ZDNVTZCJSA-N
Mol Weight 308.47 g/mol
Molecular Formula C22H28O
Exact Mass 308.214016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LXKaSQIfpqO
Name (1R*,8S*,9R*,14S*)-10,13-Dibutyl-15-oxatetracyclo[6.6.1.0(2,7).0(9,14)]pentadeca-2,4,6,10,12-pentaene
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Formula C22H28O
InChI InChI=1S/C22H28O/c1-3-5-9-15-13-14-16(10-6-4-2)20-19(15)21-17-11-7-8-12-18(17)22(20)23-21/h7-8,11-14,19-22H,3-6,9-10H2,1-2H3/t19-,20+,21+,22-
InChIKey QRIFQKZHXDVCBJ-ZDNVTZCJSA-N
Molecular Weight 308.465 g/mol
SMILES [C@@]12([C@]3([C@@](C(CCCC)=CC=C3CCCC)([H])[C@@](O1)([H])c1c2cccc1)[H])[H]
SPLASH splash10-066r-0900000000-5723115e861925e46778
Source of Spectrum KC-0-200-5
Synonyms (1R,8S,9R,14S)-10,13-dibutyl-15-oxatetracyclo[6.6.1.0(2,7).0(9,14)]pentadeca-2,4,6,10,12-pentaene
Wiley ID 829743