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9-(Hydroxymethyl)-6,11-dihydroxy-12-oxoxantho[2,3-g]tetralin
SpectraBase Compound ID 7mSwW7awkzN
InChI InChI=1S/C18H16O5/c19-8-9-5-6-10-12(7-9)16(21)14-15(20)11-3-1-2-4-13(11)23-18(14)17(10)22/h1-4,9,19,21-22H,5-8H2
InChIKey IHCFSSKONZUEPH-UHFFFAOYSA-N
Mol Weight 312.32 g/mol
Molecular Formula C18H16O5
Exact Mass 312.099774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID xx5HWuXVV
Name 9-(Hydroxymethyl)-6,11-dihydroxy-12-oxoxantho[2,3-g]tetralin
Alternate Name(s) 6,11-dihydroxy-9-(hydroxymethyl)-7,8,9,10-tetrahydro-12H-benzo[b]xanthen-12-one
CAS Registry Number 90623-72-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16O5
InChI InChI=1S/C18H16O5/c19-8-9-5-6-10-12(7-9)16(21)14-15(20)11-3-1-2-4-13(11)23-18(14)17(10)22/h1-4,9,19,21-22H,5-8H2
InChIKey IHCFSSKONZUEPH-UHFFFAOYSA-N
Molecular Weight 312.321 g/mol
SMILES Oc1c2c(c(c3c1CCC(C3)CO)O)C(c1c(O2)cccc1)=O
SPLASH splash10-03di-0069000000-9e514d5d08493716a8df
Source of Spectrum J-49-2851-0
Wiley ID 1313320