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11H-Dibenzo[b,e][1,4]dioxepin-11-one, 2-chloro-3-hydroxy-8-methoxy-1,4,6,9-tetramethyl-
SpectraBase Compound ID FifF6VsuAg2
InChI InChI=1S/C18H17ClO5/c1-7-6-11(22-5)8(2)17-15(7)23-16-10(4)14(20)13(19)9(3)12(16)18(21)24-17/h6,20H,1-5H3
InChIKey UAKCXRFJSDHUDM-UHFFFAOYSA-N
Mol Weight 348.78 g/mol
Molecular Formula C18H17ClO5
Exact Mass 348.076451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 60pHxyFSZU5
Name 11H-Dibenzo[b,e][1,4]dioxepin-11-one, 2-chloro-3-hydroxy-8-methoxy-1,4,6,9-tetramethyl-
CAS Registry Number 131840-49-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17ClO5
InChI InChI=1S/C18H17ClO5/c1-7-6-11(22-5)8(2)17-15(7)23-16-10(4)14(20)13(19)9(3)12(16)18(21)24-17/h6,20H,1-5H3
InChIKey UAKCXRFJSDHUDM-UHFFFAOYSA-N
Molecular Weight 348.782 g/mol
SMILES Oc1c(c(c2c(Oc3c(cc(c(c3OC2=O)C)OC)C)c1C)C)Cl
SPLASH splash10-000b-0419000000-cc9d19bba808d7326d9f
Source of Spectrum B-43-1957-9
Synonyms 2-Chloro-3-hydroxy-8-methoxy-1,4,6,9-tetra-methyl-11H-dibenzo[b,e][1,4]dioxepin-11-one (dechlorovicanicin) 2-Chloro-3-hydroxy-8-methoxy-1,4,6,9-tetramethyl-11H-dibenzo[b,e][1,4]dioxepin-11-one
Wiley ID 1340502