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3-Buten-2-one, 4-(4-bromophenyl)-
SpectraBase Compound ID EwCL5y6YxgB
InChI InChI=1S/C10H9BrO/c1-8(12)2-3-9-4-6-10(11)7-5-9/h2-7H,1H3/b3-2+
InChIKey ZQNVTVOTCKZKHJ-NSCUHMNNSA-N
Mol Weight 225.08 g/mol
Molecular Formula C10H9BrO
Exact Mass 223.983678 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FndNYNdJGCL
Name 3-Buten-2-one, 4-(4-bromophenyl)-
CAS Registry Number 20511-04-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9BrO
InChI InChI=1S/C10H9BrO/c1-8(12)2-3-9-4-6-10(11)7-5-9/h2-7H,1H3/b3-2+
InChIKey ZQNVTVOTCKZKHJ-NSCUHMNNSA-N
Molecular Weight 225.085 g/mol
SMILES c1cc(ccc1\C=C\C(C)=O)Br
SPLASH splash10-0zi0-5970000000-c99ca12ea0add3ebb926
Source of Spectrum 0-16-412-1
Synonyms (3E)-4-(4-Bromophenyl)-3-buten-2-one (E)-4-(4-bromophenyl)-3-buten-2-one (E)-4-(4-bromophenyl)but-3-en-2-one 4-Bromo-benzalacetone
Wiley ID 1224567