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(S)-6-Hydroxy-6-[(2'S,5'R)-5'-(1''-hydroxy-1''-methylethyl)-2'-methyl-tetrahydrofuran-2'-yl]-3-methylhex-2-enyl Benzoate
SpectraBase Compound ID 7bHLkqSl0xj
InChI InChI=1S/C22H32O5/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/h5-9,13,18-19,23,25H,10-12,14-15H2,1-4H3/b16-13+/t18-,19+,22-/m0/s1
InChIKey RUVNRLJBPVYJCJ-JDONLOHQSA-N
Mol Weight 376.5 g/mol
Molecular Formula C22H32O5
Exact Mass 376.224974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4bvDQEjF1G2
Name (S)-6-Hydroxy-6-[(2'S,5'R)-5'-(1''-hydroxy-1''-methylethyl)-2'-methyl-tetrahydrofuran-2'-yl]-3-methylhex-2-enyl Benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H32O5
InChI InChI=1S/C22H32O5/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/h5-9,13,18-19,23,25H,10-12,14-15H2,1-4H3/b16-13+/t18-,19+,22-/m0/s1
InChIKey RUVNRLJBPVYJCJ-JDONLOHQSA-N
Molecular Weight 376.493 g/mol
SMILES OC([C@@]1(O[C@]([C@](CC\C(=C\COC(=O)c2ccccc2)C)(O)[H])(CC1)C)[H])(C)C
SPLASH splash10-0006-5900000000-2bdc48dec782ed972c40
Source of Spectrum F5-5-1610-7b
Synonyms 6-Hydroxy-6-[5'-(1''-hydroxy-1''-methylethyl)-2'-methyl-tetrahydrofuran-2'-yl]-3-methylhex-2-enyl Benzoate (S,E)-6-hydroxy-6-((2S,5R)-5-(2-hydroxypropan-2-yl)-2-methyltetrahydrofuran-2-yl)-3-methylhex-2-en-1-yl benzoate
Wiley ID 1733195