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(2S,3S)-3-Methoxy-2-(4-methoxy-benzyloxy)-5-methyl-hex-5-enoic acid
SpectraBase Compound ID 1F6vuBczb1z
InChI InChI=1S/C16H22O5/c1-11(2)9-14(20-4)15(16(17)18)21-10-12-5-7-13(19-3)8-6-12/h5-8,14-15H,1,9-10H2,2-4H3,(H,17,18)/t14-,15-/m0/s1
InChIKey TXJOALBXZZIKIQ-GJZGRUSLSA-N
Mol Weight 294.35 g/mol
Molecular Formula C16H22O5
Exact Mass 294.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I1NebeGIyWI
Name (2S,3S)-3-Methoxy-2-(4-methoxy-benzyloxy)-5-methyl-hex-5-enoic acid
Alternate Name(s) 3-Methoxy-2-[(p-methoxybenzyl)oxy]-5-methylhex-5-enoic Acid (2S,3S)-3-methoxy-2-[(4-methoxyphenyl)methoxy]-5-methyl-5-hexenoic acid (2S,3S)-3-methoxy-2-[(4-methoxyphenyl)methoxy]-5-methylhex-5-enoic acid (2S,3S)-3-methoxy-2-[(4-methoxyphenyl)methoxy]-5-methyl-hex-5-enoic acid
Comments Less than 3 mono-isotopic peaks
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Formula C16H22O5
InChI InChI=1S/C16H22O5/c1-11(2)9-14(20-4)15(16(17)18)21-10-12-5-7-13(19-3)8-6-12/h5-8,14-15H,1,9-10H2,2-4H3,(H,17,18)/t14-,15-/m0/s1
InChIKey TXJOALBXZZIKIQ-GJZGRUSLSA-N
Molecular Weight 294.347 g/mol
SMILES OC([C@@](OCc1ccc(cc1)OC)([C@](CC(=C)C)(OC)[H])[H])=O
SPLASH splash10-00dj-6900000000-bedc981ce9f33358946e
Source of Spectrum U1-2009-3634-(S,S)-16
Wiley ID 1697009