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Diploicin
SpectraBase Compound ID 8o15VXUavFv
InChI InChI=1S/C16H10Cl4O5/c1-4-6-13(9(19)11(21)7(4)17)24-12-5(2)8(18)14(23-3)10(20)15(12)25-16(6)22/h21H,1-3H3
InChIKey AXZCNBVMHHTPKA-UHFFFAOYSA-N
Mol Weight 424.1 g/mol
Molecular Formula C16H10Cl4O5
Exact Mass 421.928234 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8sl9YJlE1Os
Name 11H-Dibenzo[b,e][1,4]dioxepin-11-one, 2,4,7,9-tetrachloro-3-hydroxy-8-methoxy-1,6-dimethyl-
CAS Registry Number 527-93-5
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H10Cl4O5
InChI InChI=1S/C16H10Cl4O5/c1-4-6-13(9(19)11(21)7(4)17)24-12-5(2)8(18)14(23-3)10(20)15(12)25-16(6)22/h21H,1-3H3
InChIKey AXZCNBVMHHTPKA-UHFFFAOYSA-N
Molecular Weight 424.063 g/mol
SMILES Oc1c(c(C)c2C(=O)Oc3c(c(c(c(c3Cl)OC)Cl)C)Oc2c1Cl)Cl
SPLASH splash10-000i-2109100000-dc404edbb18ddfa6d24a
Source of Spectrum SD-1981-0-0
Synonyms 2,4,7,9-Tetrachloro-3-hydroxy-8-methoxy-1,6-dimethyl-11H-dibenzo[b,e][1,4]dioxepin-11-one 2,4,8,10-tetrachloro-9-hydroxy-3-methoxy-1,7-dimethyl-6-benzo[b][1,4]benzodioxepinone 2,4,8,10-tetrachloro-9-hydroxy-3-methoxy-1,7-dimethyl-benzo[b][1,4]benzodioxepin-6-one 2,4,8,10-tetrakis(chloranyl)-3-methoxy-1,7-dimethyl-9-oxidanyl-benzo[b][1,4]benzodioxepin-6-one Diploicin Diploicine NSC 5468
Wiley ID 1378439