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Methyl 4-hydroxy-6,7-(isopropylidenedioxy)-2-methyleneheptanoate isomer
SpectraBase Compound ID E5num0jVgIl
InChI InChI=1S/C12H20O5/c1-8(11(14)15-4)5-9(13)6-10-7-16-12(2,3)17-10/h9-10,13H,1,5-7H2,2-4H3/t9-,10+/m1/s1
InChIKey IVIKEGJOVHFLDM-ZJUUUORDSA-N
Mol Weight 244.29 g/mol
Molecular Formula C12H20O5
Exact Mass 244.131074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IiJNdjiIcXj
Name Methyl 4-hydroxy-6,7-(isopropylidenedioxy)-2-methyleneheptanoate isomer
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O5
InChI InChI=1S/C12H20O5/c1-8(11(14)15-4)5-9(13)6-10-7-16-12(2,3)17-10/h9-10,13H,1,5-7H2,2-4H3/t9-,10+/m1/s1
InChIKey IVIKEGJOVHFLDM-ZJUUUORDSA-N
Molecular Weight 244.287 g/mol
SMILES O[C@@](C[C@@]1(OC(C)(C)OC1)[H])(CC(C(=O)OC)=C)[H]
SPLASH splash10-00kk-9700000000-7ca55b8c657dc6f7d8de
Source of Spectrum KC-0-908-43
Synonyms (R)-5-((S)-2,2-Dimethyl-[1,3]dioxolan-4-yl)-4-hydroxy-2-methylene-pentanoic acid methyl ester
Wiley ID 830162