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11H-Dibenzo[b,e][1,4]dioxepin-11-one, 2,4,7-trichloro-3-hydroxy-8-methoxy-1,6-dimethyl-
SpectraBase Compound ID CKedoUSpUpx
InChI InChI=1S/C16H11Cl3O5/c1-5-9-15(12(19)13(20)11(5)18)24-14-6(2)10(17)7(22-3)4-8(14)23-16(9)21/h4,20H,1-3H3
InChIKey XEDMLQPKKYHCKK-UHFFFAOYSA-N
Mol Weight 389.62 g/mol
Molecular Formula C16H11Cl3O5
Exact Mass 387.967207 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H3k0pt671MM
Name 11H-Dibenzo[b,e][1,4]dioxepin-11-one, 2,4,7-trichloro-3-hydroxy-8-methoxy-1,6-dimethyl-
CAS Registry Number 71339-43-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H11Cl3O5
InChI InChI=1S/C16H11Cl3O5/c1-5-9-15(12(19)13(20)11(5)18)24-14-6(2)10(17)7(22-3)4-8(14)23-16(9)21/h4,20H,1-3H3
InChIKey XEDMLQPKKYHCKK-UHFFFAOYSA-N
Molecular Weight 389.618 g/mol
SMILES Oc1c(c(c2c(Oc3c(c(Cl)c(cc3OC2=O)OC)C)c1Cl)C)Cl
SPLASH splash10-0zfr-0209000000-fc2855fd9c6a2acf4874
Source of Spectrum KC-1981-866-0
Synonyms 2,4,7-trichloro-3-hydroxy-8-methoxy-1,6-dimethyl-11H-dibenzo[b,e][1,4]dioxepin-11-one 2,4,7-Trichloro-3-hydroxy-8-methoxy-1,6-dimethyldibenzo[b,e][1,4]dioxepin-11-one Fulgidin Isofulgidin
Wiley ID 1363597