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5-CHLORO-1,8-DIHYDROXY-4-METHOXY-3-METHYL-9H-XANTHEN-9-ONE;2-DECHLOROTHIOMELIN
SpectraBase Compound ID JCw7PYsQAKY
InChI InChI=1S/C15H11ClO5/c1-6-5-9(18)11-12(19)10-8(17)4-3-7(16)14(10)21-15(11)13(6)20-2/h3-5,17-18H,1-2H3
InChIKey HTHXWUNCBPQPCS-UHFFFAOYSA-N
Mol Weight 306.7 g/mol
Molecular Formula C15H11ClO5
Exact Mass 306.029501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6fRnEVAAM55
Name 5-chloranyl-4-methoxy-3-methyl-1,8-bis(oxidanyl)xanthen-9-one
Alternate Name(s) 5-chloro-1,8-dihydroxy-4-methoxy-3-methyl-9-xanthenone 5-chloro-1,8-dihydroxy-4-methoxy-3-methyl-xanthen-9-one 5-chloro-1,8-dihydroxy-4-methoxy-3-methyl-xanthone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H11ClO5
InChI InChI=1S/C15H11ClO5/c1-6-5-9(18)11-12(19)10-8(17)4-3-7(16)14(10)21-15(11)13(6)20-2/h3-5,17-18H,1-2H3
InChIKey HTHXWUNCBPQPCS-UHFFFAOYSA-N
Molecular Weight 306.701 g/mol
SMILES Oc1cc(c(c2c1C(c1c(ccc(c1O2)Cl)O)=O)OC)C
SPLASH splash10-0006-0093000000-dfdec7e06f36311e98ec
Source of Spectrum B-46-95-0
Wiley ID 1307827