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1,2,9,10-Cyclohexadecanetetrone

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1,2,9,10-Cyclohexadecanetetrone
SpectraBase Compound ID 4XYTRz9j5Vl
InChI InChI=1S/C16H24O4/c17-13-9-5-1-2-6-10-14(18)16(20)12-8-4-3-7-11-15(13)19/h1-12H2
InChIKey DPUBHZDXQMECGQ-UHFFFAOYSA-N
Mol Weight 280.36 g/mol
Molecular Formula C16H24O4
Exact Mass 280.167459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6URtgjsEPRF
Name 1,2,9,10-Cyclohexadecanetetrone
CAS Registry Number 116905-01-2
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H24O4
InChI InChI=1S/C16H24O4/c17-13-9-5-1-2-6-10-14(18)16(20)12-8-4-3-7-11-15(13)19/h1-12H2
InChIKey DPUBHZDXQMECGQ-UHFFFAOYSA-N
Molecular Weight 280.364 g/mol
SMILES C1(C(=O)CCCCCCC(C(CCCCCC1)=O)=O)=O
SPLASH splash10-0a4i-9020000000-b5f6ee3bd59564b73ba4
Source of Spectrum K-124-928-4
Synonyms cyclohexadecane-1,2,9,10-diquinone cyclohexadecane-1,2,9,10-tetrone
Wiley ID 1283996