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6,8-Dimethoxy-3-hydroxy-3-pentadecyl-3,4-dihydroisocoumarin
SpectraBase Compound ID 2kZT6VR6SEB
InChI InChI=1S/C26H42O5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-26(28)20-21-18-22(29-2)19-23(30-3)24(21)25(27)31-26/h18-19,28H,4-17,20H2,1-3H3
InChIKey YXVXZKUPAHQJMN-UHFFFAOYSA-N
Mol Weight 434.6 g/mol
Molecular Formula C26H42O5
Exact Mass 434.303224 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9TtBwnlV3PS
Name 6,8-Dimethoxy-3-hydroxy-3-pentadecyl-3,4-dihydroisocoumarin
Alternate Name(s) 3-Hydroxy-6,8-dimethoxy-3-pentadecyl-3,4-dihydro-1H-2-benzopyran-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H42O5
InChI InChI=1S/C26H42O5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-26(28)20-21-18-22(29-2)19-23(30-3)24(21)25(27)31-26/h18-19,28H,4-17,20H2,1-3H3
InChIKey YXVXZKUPAHQJMN-UHFFFAOYSA-N
Molecular Weight 434.617 g/mol
SMILES OC1(OC(=O)c2c(C1)cc(cc2OC)OC)CCCCCCCCCCCCCCC
SPLASH splash10-00mo-0808900000-732b7944f4c3525628ad
Source of Spectrum AH-134-461-4
Wiley ID 1546858