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Butanedioic acid, (2,2-dimethylpropylidene)-
SpectraBase Compound ID 5BDxcFHHvXy
InChI InChI=1S/C9H14O4/c1-9(2,3)5-6(8(12)13)4-7(10)11/h5H,4H2,1-3H3,(H,10,11)(H,12,13)/b6-5+
InChIKey UTAVRWMVAXKFQV-AATRIKPKSA-N
Mol Weight 186.21 g/mol
Molecular Formula C9H14O4
Exact Mass 186.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4M6TYHYevkx
Name Butanedioic acid, (2,2-dimethylpropylidene)-
CAS Registry Number 40938-21-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14O4
InChI InChI=1S/C9H14O4/c1-9(2,3)5-6(8(12)13)4-7(10)11/h5H,4H2,1-3H3,(H,10,11)(H,12,13)/b6-5+
InChIKey UTAVRWMVAXKFQV-AATRIKPKSA-N
Molecular Weight 186.207 g/mol
SMILES OC(C\C(C(O)=O)=C\C(C)(C)C)=O
SPLASH splash10-002f-9400000000-550083471d9c6e7c6d62
Source of Spectrum SD-1981-0-0
Synonyms (2E)-2-(2,2-Dimethylpropylidene)butanedioic acid (2E)-2-neopentylidenesuccinic acid
Wiley ID 1182487