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1-Hydroxy-3-n-hexyl-9-methyl-7,8,9,10-tetrahydro-6-dibenzopyrone
SpectraBase Compound ID GEvdPfQ2Y12
InChI InChI=1S/C20H26O3/c1-3-4-5-6-7-14-11-17(21)19-16-10-13(2)8-9-15(16)20(22)23-18(19)12-14/h11-13,21H,3-10H2,1-2H3
InChIKey ICDBBXTXPHUQSO-UHFFFAOYSA-N
Mol Weight 314.43 g/mol
Molecular Formula C20H26O3
Exact Mass 314.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GazL1gUo4eO
Name 1-Hydroxy-3-n-hexyl-9-methyl-7,8,9,10-tetrahydro-6-dibenzopyrone
Alternate Name(s) 3-Hexyl-1-hydroxy-9-methyl-7,8,9,10-tetrahydro-6H-benzo[c]chromen-6-one
CAS Registry Number 56694-86-1
Comments Structure changed after expert review
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H26O3
InChI InChI=1S/C20H26O3/c1-3-4-5-6-7-14-11-17(21)19-16-10-13(2)8-9-15(16)20(22)23-18(19)12-14/h11-13,21H,3-10H2,1-2H3
InChIKey ICDBBXTXPHUQSO-UHFFFAOYSA-N
Molecular Weight 314.425 g/mol
SMILES Oc1c2C=3CC(CCC3C(Oc2cc(CCCCCC)c1)=O)C
SPLASH splash10-01ox-2194000000-8befca016ca1579c9bbd
Source of Spectrum JZ-1992-4459-0
Wiley ID 1315418