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Phenol, 2,6-bis[(5-chloro-2-hydroxyphenyl)methyl]-4-nitro-
SpectraBase Compound ID FMA7viLn9z0
InChI InChI=1S/C20H15Cl2NO5/c21-15-1-3-18(24)11(7-15)5-13-9-17(23(27)28)10-14(20(13)26)6-12-8-16(22)2-4-19(12)25/h1-4,7-10,24-26H,5-6H2
InChIKey HXJBLZKZGCMPEW-UHFFFAOYSA-N
Mol Weight 420.25 g/mol
Molecular Formula C20H15Cl2NO5
Exact Mass 419.032728 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FKOd9iKPEub
Name Phenol, 2,6-bis[(5-chloro-2-hydroxyphenyl)methyl]-4-nitro-
CAS Registry Number 71643-57-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H15Cl2NO5
InChI InChI=1S/C20H15Cl2NO5/c21-15-1-3-18(24)11(7-15)5-13-9-17(23(27)28)10-14(20(13)26)6-12-8-16(22)2-4-19(12)25/h1-4,7-10,24-26H,5-6H2
InChIKey HXJBLZKZGCMPEW-UHFFFAOYSA-N
Molecular Weight 420.248 g/mol
SMILES Oc1c(Cc2cc(cc(Cc3c(ccc(c3)Cl)O)c2O)N(=O)=O)cc(cc1)Cl
SPLASH splash10-0006-0743900000-ade48abb9d37b1cb5524
Source of Spectrum F-46-678-11
Synonyms 2,6-bis(5-chloro-2-hydroxy-benzyl)-4-nitro-phenol 2,6-bis[(5-chloranyl-2-oxidanyl-phenyl)methyl]-4-nitro-phenol 2,6-bis[(5-chloro-2-hydroxy-phenyl)methyl]-4-nitro-phenol
Wiley ID 1377562