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5-Chloranyl-1,4-dimethoxy-3-methyl-8-oxidanyl-xanthen-9-one
SpectraBase Compound ID IiednU03vnL
InChI InChI=1S/C16H13ClO5/c1-7-6-10(20-2)12-13(19)11-9(18)5-4-8(17)15(11)22-16(12)14(7)21-3/h4-6,18H,1-3H3
InChIKey SWHQOGSBEAKAGP-UHFFFAOYSA-N
Mol Weight 320.73 g/mol
Molecular Formula C16H13ClO5
Exact Mass 320.045151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 42VrbWKRiB1
Name 5-Chloranyl-1,4-dimethoxy-3-methyl-8-oxidanyl-xanthen-9-one
CAS Registry Number 113996-94-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13ClO5
InChI InChI=1S/C16H13ClO5/c1-7-6-10(20-2)12-13(19)11-9(18)5-4-8(17)15(11)22-16(12)14(7)21-3/h4-6,18H,1-3H3
InChIKey SWHQOGSBEAKAGP-UHFFFAOYSA-N
Molecular Weight 320.728 g/mol
SMILES Oc1c2C(c3c(Oc2c(cc1)Cl)c(OC)c(cc3OC)C)=O
SPLASH splash10-0fk9-0019000000-011ef60684f52184e289
Source of Spectrum B-40-1175-10
Synonyms 9H-Xanthen-9-one, 5-chloro-8-hydroxy-1,4-dimethoxy-3-methyl- 5-Chloro-8-hydroxy-1,4-dimethoxy-3-methyl-9-xanthenone 5-Chloro-8-hydroxy-1,4-dimethoxy-3-methyl-xanthen-9-one 5-Chloro-8-hydroxy-1,4-dimethoxy-3-methyl-xanthone
Wiley ID 1319894