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11H-Dibenzo[b,e][1,4]dioxepin-4-carboxaldehyde, 2,7-dichloro-3-hydroxy-8-methoxy-1,6-dimethyl-11-oxo-
SpectraBase Compound ID 2Cz1ZdMveGU
InChI InChI=1S/C17H12Cl2O6/c1-6-11-16(8(5-20)14(21)13(6)19)25-15-7(2)12(18)9(23-3)4-10(15)24-17(11)22/h4-5,21H,1-3H3
InChIKey HZFIZEFIKOIHGY-UHFFFAOYSA-N
Mol Weight 383.18 g/mol
Molecular Formula C17H12Cl2O6
Exact Mass 382.001094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G6v3PycRmzY
Name 11H-Dibenzo[b,e][1,4]dioxepin-4-carboxaldehyde, 2,7-dichloro-3-hydroxy-8-methoxy-1,6-dimethyl-11-oxo-
Alternate Name(s) 2,7-Dichloro-3-hydroxy-8-methoxy-1,6-dimethyl-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-4-carbaldehyde Dichloro-2,7-formyl-4-hydroxy-3-methoxy-8-dimethyl-1,6-11H-dibenzo[b,e][1,4]dioxepin-11-one Eriodermin
CAS Registry Number 92070-80-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12Cl2O6
InChI InChI=1S/C17H12Cl2O6/c1-6-11-16(8(5-20)14(21)13(6)19)25-15-7(2)12(18)9(23-3)4-10(15)24-17(11)22/h4-5,21H,1-3H3
InChIKey HZFIZEFIKOIHGY-UHFFFAOYSA-N
Molecular Weight 383.183 g/mol
SMILES Oc1c(c(c2c(c1C=O)Oc1c(c(Cl)c(cc1OC2=O)OC)C)C)Cl
SPLASH splash10-001j-0009000000-fb3e2a2a8084e36a8d37
Source of Spectrum H-68-948-12
Wiley ID 1360390