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7-Benzyloxy-8-(1,2,3-trihydroxy-3-methylbutyl)coumarin
SpectraBase Compound ID HSh3fcb95JY
InChI InChI=1S/C21H22O6/c1-21(2,25)20(24)18(23)17-15(26-12-13-6-4-3-5-7-13)10-8-14-9-11-16(22)27-19(14)17/h3-11,18,20,23-25H,12H2,1-2H3
InChIKey CFOYHDWCMKMWFS-UHFFFAOYSA-N
Mol Weight 370.4 g/mol
Molecular Formula C21H22O6
Exact Mass 370.141638 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4a0e401Ia3X
Name 7-Benzyloxy-8-(1,2,3-trihydroxy-3-methylbutyl)coumarin
Alternate Name(s) 7-(benzyloxy)-8-(1,2,3-trihydroxy-3-methylbutyl)-2H-chromen-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22O6
InChI InChI=1S/C21H22O6/c1-21(2,25)20(24)18(23)17-15(26-12-13-6-4-3-5-7-13)10-8-14-9-11-16(22)27-19(14)17/h3-11,18,20,23-25H,12H2,1-2H3
InChIKey CFOYHDWCMKMWFS-UHFFFAOYSA-N
Molecular Weight 370.401 g/mol
SMILES OC(C(C(c1c2OC(=O)C=Cc2ccc1OCc1ccccc1)O)O)(C)C
SPLASH splash10-004l-9220000000-ca7eec2f86a03a42a8ef
Source of Spectrum KC-0-3254-11
Wiley ID 782634