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2,4-Pentanedione, 3-butyl-3-hydroxy-, benzoate
SpectraBase Compound ID L8uAi9Ddbkb
InChI InChI=1S/C16H20O4/c1-4-5-11-16(12(2)17,13(3)18)20-15(19)14-9-7-6-8-10-14/h6-10H,4-5,11H2,1-3H3
InChIKey FPCBTOSTZACGNY-UHFFFAOYSA-N
Mol Weight 276.33 g/mol
Molecular Formula C16H20O4
Exact Mass 276.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3qxuuNdEOU9
Name 2,4-Pentanedione, 3-butyl-3-hydroxy-, benzoate
CAS Registry Number 10225-36-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O4
InChI InChI=1S/C16H20O4/c1-4-5-11-16(12(2)17,13(3)18)20-15(19)14-9-7-6-8-10-14/h6-10H,4-5,11H2,1-3H3
InChIKey FPCBTOSTZACGNY-UHFFFAOYSA-N
Molecular Weight 276.332 g/mol
SMILES C(OC(=O)c1ccccc1)(C(=O)C)(C(=O)C)CCCC
SPLASH splash10-0a4i-2910000000-6f7852d2e06488003380
Source of Spectrum AD-0-4945-0
Synonyms 1,1-Diacetylpentyl benzoate 3-Acetyl-3-benzoyloxy-heptan-2-one
Wiley ID 1280126