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(4-ALLYL-2-tert-BUTYL-5-OXO-[1,3]DIOXOLAN-4-YL)ACETIC ACID
SpectraBase Compound ID 4zjnl3gU2cL
InChI InChI=1S/C6H8O3.C4H10.C2H4O2/c1-2-3-5-6(7)9-4-8-5;1-4(2)3;1-2(3)4/h2,5H,1,3-4H2;4H,1-3H3;1H3,(H,3,4)
InChIKey RBSRLWHLMWLWDP-UHFFFAOYSA-N
Mol Weight 246.3 g/mol
Molecular Formula C12H22O5
Exact Mass 246.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6k2Fx3XpXGo
Name (4-ALLYL-2-tert-BUTYL-5-OXO-[1,3]DIOXOLAN-4-YL)ACETIC ACID
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H18O5
InChI InChI=1S/C6H8O3.C4H10.C2H4O2/c1-2-3-5-6(7)9-4-8-5;1-4(2)3;1-2(3)4/h2,5H,1,3-4H2;4H,1-3H3;1H3,(H,3,4)
InChIKey RBSRLWHLMWLWDP-UHFFFAOYSA-N
Molecular Weight 246.1461
SMILES OC(=O)C.C1OC(C(O1)=O)CC=C.CC(C)C
SPLASH splash10-000l-9400000000-e349ad04fbcd643671dc
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany