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6-[5'-(1''-Hydroxy-1''-methylethyl)-2'-methyl-tetrahydrofuran-2'-yl]-3-methyl-6-oxohex-2-enyl Benzoate
SpectraBase Compound ID 3qcMVF6CtPa
InChI InChI=1S/C22H30O5/c1-16(13-15-26-20(24)17-8-6-5-7-9-17)10-11-18(23)22(4)14-12-19(27-22)21(2,3)25/h5-9,13,19,25H,10-12,14-15H2,1-4H3/b16-13+
InChIKey HEFRCZXXBNWONZ-DTQAZKPQSA-N
Mol Weight 374.48 g/mol
Molecular Formula C22H30O5
Exact Mass 374.209324 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID kJocGGjnLA
Name 6-[5'-(1''-Hydroxy-1''-methylethyl)-2'-methyl-tetrahydrofuran-2'-yl]-3-methyl-6-oxohex-2-enyl Benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H30O5
InChI InChI=1S/C22H30O5/c1-16(13-15-26-20(24)17-8-6-5-7-9-17)10-11-18(23)22(4)14-12-19(27-22)21(2,3)25/h5-9,13,19,25H,10-12,14-15H2,1-4H3/b16-13+
InChIKey HEFRCZXXBNWONZ-DTQAZKPQSA-N
Molecular Weight 374.477 g/mol
SMILES OC(C1OC(C(=O)CC\C(=C\COC(=O)c2ccccc2)C)(CC1)C)(C)C
SPLASH splash10-0006-0900000000-7090e7b7488129e92fb0
Source of Spectrum F5-5-1610-10b
Synonyms (E)-6-(5-(2-hydroxypropan-2-yl)-2-methyltetrahydrofuran-2-yl)-3-methyl-6-oxohex-2-en-1-yl benzoate
Wiley ID 1733194