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(3Z,9Z)-3,9-Dodecadiene-2,5,8,11-tetraone

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(3Z,9Z)-3,9-Dodecadiene-2,5,8,11-tetraone
SpectraBase Compound ID 2Zo4FP1CtDN
InChI InChI=1S/C12H14O4/c1-9(13)3-5-11(15)7-8-12(16)6-4-10(2)14/h3-6H,7-8H2,1-2H3/b5-3-,6-4-
InChIKey FDBRYEJOCPSNBN-GLIMQPGKSA-N
Mol Weight 222.24 g/mol
Molecular Formula C12H14O4
Exact Mass 222.089209 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9yGV8EywtUu
Name (3Z,9Z)-3,9-Dodecadiene-2,5,8,11-tetraone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 222.089208927 u
Formula C12H14O4
InChI InChI=1S/C12H14O4/c1-9(13)3-5-11(15)7-8-12(16)6-4-10(2)14/h3-6H,7-8H2,1-2H3/b5-3-,6-4-
InChIKey FDBRYEJOCPSNBN-GLIMQPGKSA-N
Molecular Weight 222.240 g/mol
SMILES C(\C=C/C(=O)CCC(\C=C/C(=O)C)=O)(=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.961997