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2-Methoxy-5-pentyl-1,4-benzoquinone
SpectraBase Compound ID CJZxplA0T8r
InChI InChI=1S/C12H16O3/c1-3-4-5-6-9-7-11(14)12(15-2)8-10(9)13/h7-8H,3-6H2,1-2H3
InChIKey PJDBHFMMKJJSCM-UHFFFAOYSA-N
Mol Weight 208.26 g/mol
Molecular Formula C12H16O3
Exact Mass 208.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GYShrYtY47M
Name 2-Methoxy-5-pentyl-1,4-benzoquinone
Alternate Name(s) 2-Methoxy-5-pentylcyclohexa-2,5-diene-1,4-dione 2-Methoxy-5-pentyl-cyclohexa-2,5-diene-1,4-dione
CAS Registry Number 15116-19-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O3
InChI InChI=1S/C12H16O3/c1-3-4-5-6-9-7-11(14)12(15-2)8-10(9)13/h7-8H,3-6H2,1-2H3
InChIKey PJDBHFMMKJJSCM-UHFFFAOYSA-N
Molecular Weight 208.257 g/mol
SMILES C1=C(C(=O)C=C(C1=O)CCCCC)OC
SPLASH splash10-0g4i-9700000000-eae2ce8117f10b31496d
Source of Spectrum OP-23-642-6
Wiley ID 850279