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2-Ethynyl-1,4,4a,5,8,8a-hexahydronaphthalene-5,8-dione
SpectraBase Compound ID AZUX8StuW7L
InChI InChI=1S/C12H10O2/c1-2-8-3-4-9-10(7-8)12(14)6-5-11(9)13/h1,3,5-6,9-10H,4,7H2
InChIKey KZBUXJBBUPDABA-UHFFFAOYSA-N
Mol Weight 186.21 g/mol
Molecular Formula C12H10O2
Exact Mass 186.06808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0qPHwm9grV
Name 2-Ethynyl-1,4,4a,5,8,8a-hexahydronaphthalene-5,8-dione
Alternate Name(s) 6-Ethynyl-4a,5,8,8a-tetrahydro-1,4-naphthalenedione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10O2
InChI InChI=1S/C12H10O2/c1-2-8-3-4-9-10(7-8)12(14)6-5-11(9)13/h1,3,5-6,9-10H,4,7H2
InChIKey KZBUXJBBUPDABA-UHFFFAOYSA-N
Molecular Weight 186.210 g/mol
SMILES C12C(C(=O)C=CC2=O)CC=C(C#C)C1
SPLASH splash10-0f9l-0900000000-620961c0a312f0894b96
Source of Spectrum U-1996-820-4
Wiley ID 768419