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(S)-2-[(2R,5S,6R)-6-[(S)-1-(4-Methoxybenzyloxymethyl)ethyl]-5-methyltetrahydropyran-2-yl]butanoic acid
SpectraBase Compound ID FIO5H8BX8YP
InChI InChI=1S/C21H32O5/c1-5-18(21(22)23)19-11-6-14(2)20(26-19)15(3)12-25-13-16-7-9-17(24-4)10-8-16/h7-10,14-15,18-20H,5-6,11-13H2,1-4H3,(H,22,23)/t14-,15-,18-,19+,20+/m0/s1
InChIKey VEFGDFRUSIVDCX-TYIJSKFUSA-N
Mol Weight 364.5 g/mol
Molecular Formula C21H32O5
Exact Mass 364.224974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J7g2rieBFth
Name (S)-2-[(2R,5S,6R)-6-[(S)-1-(4-Methoxybenzyloxymethyl)ethyl]-5-methyltetrahydropyran-2-yl]butanoic acid
Alternate Name(s) (2S)-2-((2R,5S,6R)-6-{(1S)-2-[(4-methoxybenzyl)oxy]-1-methylethyl}-5-methyltetrahydro-2H-pyran-2-yl)butanoic acid
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Formula C21H32O5
InChI InChI=1S/C21H32O5/c1-5-18(21(22)23)19-11-6-14(2)20(26-19)15(3)12-25-13-16-7-9-17(24-4)10-8-16/h7-10,14-15,18-20H,5-6,11-13H2,1-4H3,(H,22,23)/t14-,15-,18-,19+,20+/m0/s1
InChIKey VEFGDFRUSIVDCX-TYIJSKFUSA-N
Molecular Weight 364.482 g/mol
SMILES OC([C@]([C@@]1(O[C@@]([C@](COCc2ccc(cc2)OC)(C)[H])([C@](CC1)(C)[H])[H])[H])(CC)[H])=O
SPLASH splash10-00di-0910000000-af533dff20d25393ba01
Source of Spectrum E1-37-1702-16
Wiley ID 1517792