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1,2,2-Butanetricarboxylic acid, 4-(tetrahydro-2-methyl-2-furanyl)-, 1-ethyl ester
SpectraBase Compound ID 25yTEHrLCYx
InChI InChI=1S/C14H22O7/c1-3-20-10(15)9-14(11(16)17,12(18)19)7-6-13(2)5-4-8-21-13/h3-9H2,1-2H3,(H,16,17)(H,18,19)
InChIKey XZPLWUDWOCSVAT-UHFFFAOYSA-N
Mol Weight 302.32 g/mol
Molecular Formula C14H22O7
Exact Mass 302.136553 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Dqj1iDP3Jg
Name 1,2,2-Butanetricarboxylic acid, 4-(tetrahydro-2-methyl-2-furanyl)-, 1-ethyl ester
Alternate Name(s) 1-Ethyl dihydrogen 4-(tetrahydro-2-methyl-2-furanyl)-1,2,2-butanetricarboxylate 2-(2-Ethoxy-2-oxoethyl)-2-[2-(2-methyltetrahydro-2-furanyl)ethyl]malonic acid
CAS Registry Number 94483-81-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O7
InChI InChI=1S/C14H22O7/c1-3-20-10(15)9-14(11(16)17,12(18)19)7-6-13(2)5-4-8-21-13/h3-9H2,1-2H3,(H,16,17)(H,18,19)
InChIKey XZPLWUDWOCSVAT-UHFFFAOYSA-N
Molecular Weight 302.323 g/mol
SMILES OC(C(C(=O)O)(CCC1(OCCC1)C)CC(=O)OCC)=O
SPLASH splash10-000i-9000000000-a27ff572fec9375bcb8a
Source of Spectrum J-50-214-0
Wiley ID 1304368