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1,3,4,6-Hexanetetrone, 1-(4-bromophenyl)-6-phenyl-
SpectraBase Compound ID DjU8gB6UHUB
InChI InChI=1S/C18H13BrO4/c19-14-8-6-13(7-9-14)16(21)11-18(23)17(22)10-15(20)12-4-2-1-3-5-12/h1-9H,10-11H2
InChIKey XDDXVAYOJVFIDS-UHFFFAOYSA-N
Mol Weight 373.2 g/mol
Molecular Formula C18H13BrO4
Exact Mass 371.999722 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AkAsc4j0S7F
Name 1,3,4,6-Hexanetetrone, 1-(4-bromophenyl)-6-phenyl-
CAS Registry Number 58330-13-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H13BrO4
InChI InChI=1S/C18H13BrO4/c19-14-8-6-13(7-9-14)16(21)11-18(23)17(22)10-15(20)12-4-2-1-3-5-12/h1-9H,10-11H2
InChIKey XDDXVAYOJVFIDS-UHFFFAOYSA-N
Molecular Weight 373.202 g/mol
SMILES c1ccc(cc1)C(CC(C(CC(c1ccc(cc1)Br)=O)=O)=O)=O
SPLASH splash10-002b-3930000000-23e1625995eedd1ed183
Source of Spectrum O-10-902-1
Synonyms 1-(4-Bromophenyl)-6-phenyl-1,3,4,6-hexanetetrone 1-(4-bromophenyl)-6-phenyl-hexane-1,3,4,6-tetrone
Wiley ID 1355287