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(2-hydroxyehtyl)-3-methyl-5,6,7,8-tetrahydro-9H-5,8-epoxybenzo[7]annulen-9-one
SpectraBase Compound ID J1q8q6Nr3lt
InChI InChI=1S/C14H16O3/c1-8-2-3-10-11(6-8)12-7-9(4-5-15)14(17-12)13(10)16/h2-3,6,9,12,14-15H,4-5,7H2,1H3/t9-,12+,14-/m1/s1
InChIKey FLRLSEWVKVLEDK-LJWDBELGSA-N
Mol Weight 232.28 g/mol
Molecular Formula C14H16O3
Exact Mass 232.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DCZm9mvQw8
Name (2-hydroxyehtyl)-3-methyl-5,6,7,8-tetrahydro-9H-5,8-epoxybenzo[7]annulen-9-one
Alternate Name(s) (5S,7R,8R)-7-(2-hydroxyethyl)-3-methyl-7,8-dihydro-5H-5,8-epoxybenzo[7]annulen-9(6H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O3
InChI InChI=1S/C14H16O3/c1-8-2-3-10-11(6-8)12-7-9(4-5-15)14(17-12)13(10)16/h2-3,6,9,12,14-15H,4-5,7H2,1H3/t9-,12+,14-/m1/s1
InChIKey FLRLSEWVKVLEDK-LJWDBELGSA-N
Literature Reference DOI 10.1002/anie.201410723
Molecular Weight 232.279 g/mol
SMILES OCC[C@@]1(C[C@]2(c3cc(ccc3C([C@@]1(O2)[H])=O)C)[H])[H]
SPLASH splash10-01ot-1900000000-64000ef02f3fe33cea16
Source of Spectrum ACI-54-3043/SM26-5u
Wiley ID 1760471