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(3R)-6,8-DIHYDROXY-3-UNDECYL-3,4-DIHYDROISOCOUMARIN
SpectraBase Compound ID GmxHEIszWh3
InChI InChI=1S/C20H30O4/c1-2-3-4-5-6-7-8-9-10-11-17-13-15-12-16(21)14-18(22)19(15)20(23)24-17/h12,14,17,21-22H,2-11,13H2,1H3/t17-/m1/s1
InChIKey GVCQCHAXJPRWFB-QGZVFWFLSA-N
Mol Weight 334.46 g/mol
Molecular Formula C20H30O4
Exact Mass 334.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2okDZtxcjGR
Name (3R)-6,8-dihydroxy-3-undecyl-3,4-dihydro-1H-2-benzopyran-1-one
Alternate Name(s) (3R)-6,8-dihydroxy-3-undecyl-3,4-dihydroisochromen-1-one (3R)-6,8-bis(oxidanyl)-3-undecyl-3,4-dihydroisochromen-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30O4
InChI InChI=1S/C20H30O4/c1-2-3-4-5-6-7-8-9-10-11-17-13-15-12-16(21)14-18(22)19(15)20(23)24-17/h12,14,17,21-22H,2-11,13H2,1H3/t17-/m1/s1
InChIKey GVCQCHAXJPRWFB-QGZVFWFLSA-N
Molecular Weight 334.456 g/mol
SMILES Oc1cc(cc2C[C@](OC(c12)=O)(CCCCCCCCCCC)[H])O
SPLASH splash10-0fc0-0902000000-2f9917ae6cfdd428c539
Source of Spectrum H-86-383-1
Wiley ID 1525249