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11H-Dibenzo[b,e][1,4]dioxepin-6-carboxaldehyde, 2,7-dichloro-3,8-dihydroxy-1,4,9-trimethyl-11-oxo-
SpectraBase Compound ID CgzoRtkNXxr
InChI InChI=1S/C17H12Cl2O6/c1-5-9-14(6(2)12(21)10(5)18)24-16-8(4-20)11(19)13(22)7(3)15(16)25-17(9)23/h4,21-22H,1-3H3
InChIKey OJTCPSGNUOWJKV-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 8VTjPC6EwYf
Name 11H-Dibenzo[b,e][1,4]dioxepin-6-carboxaldehyde, 2,7-dichloro-3,8-dihydroxy-1,4,9-trimethyl-11-oxo-
Alternate Name(s) 2,7-Dichloro-3,8-dihydroxy-1,4,9-trimethyl-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-6-carbaldehyde
CAS Registry Number 84592-24-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12Cl2O6
InChI InChI=1S/C17H12Cl2O6/c1-5-9-14(6(2)12(21)10(5)18)24-16-8(4-20)11(19)13(22)7(3)15(16)25-17(9)23/h4,21-22H,1-3H3
InChIKey OJTCPSGNUOWJKV-UHFFFAOYSA-N
Molecular Weight 383.183 g/mol
SMILES Oc1c(c(c2Oc3c(c(c(c(c3C)O)Cl)C)C(Oc2c1C)=O)C=O)Cl
SPLASH splash10-000t-0009000000-a19ca877bcecc943e7b4
Source of Spectrum B-35-2333-0
Wiley ID 1360387