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4-HYDROXY-4-(5-HYDROXYMETHYL-2,2-DIMETHYL-[1,3]DIOXOLAN-4-YL)BUT-2-ENOIC ACID, ETHYL ESTER
SpectraBase Compound ID SIqzcgS7Ig
InChI InChI=1S/C12H20O6/c1-4-16-10(15)6-5-8(14)11-9(7-13)17-12(2,3)18-11/h5-6,8-9,11,13-14H,4,7H2,1-3H3/b6-5+
InChIKey MOHHXFKWUZSPTE-AATRIKPKSA-N
Mol Weight 260.29 g/mol
Molecular Formula C12H20O6
Exact Mass 260.125988 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GTyG8PFzxP5
Name 4-HYDROXY-4-(5-HYDROXYMETHYL-2,2-DIMETHYL-[1,3]DIOXOLAN-4-YL)BUT-2-ENOIC ACID, ETHYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H20O6
InChI InChI=1S/C12H20O6/c1-4-16-10(15)6-5-8(14)11-9(7-13)17-12(2,3)18-11/h5-6,8-9,11,13-14H,4,7H2,1-3H3/b6-5+
InChIKey MOHHXFKWUZSPTE-AATRIKPKSA-N
Molecular Weight 260.1254
SMILES OCC1OC(OC1C(\C=C\C(OCC)=O)O)(C)C
SPLASH splash10-0a59-9400000000-d0a93f86bdf176a137bc
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany