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1,2,8,9-Cyclotetradecanetetrone
SpectraBase Compound ID 6gWc1CS4eUv
InChI InChI=1S/C14H20O4/c15-11-7-3-1-4-8-12(16)14(18)10-6-2-5-9-13(11)17/h1-10H2
InChIKey NOKFSAOIXCJORA-UHFFFAOYSA-N
Mol Weight 252.31 g/mol
Molecular Formula C14H20O4
Exact Mass 252.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 27D5ZoqlMGp
Name 1,2,8,9-Cyclotetradecanetetrone
Alternate Name(s) 1,2,8,9-Cyclododecanetetrone
CAS Registry Number 118006-71-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O4
InChI InChI=1S/C14H20O4/c15-11-7-3-1-4-8-12(16)14(18)10-6-2-5-9-13(11)17/h1-10H2
InChIKey NOKFSAOIXCJORA-UHFFFAOYSA-N
Molecular Weight 252.310 g/mol
SMILES C1(C(=O)CCCCCC(C(CCCCC1)=O)=O)=O
SPLASH splash10-03fr-0920000000-112e33e9f40c329e8d6b
Source of Spectrum H-71-239-0
Wiley ID 1255581