Debug Info

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_id
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D50JWfdn6L2
spectrumID
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D50JWfdn6L2
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analyticalTechnique
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13C NMR
analyticalTechniqueLongName
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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3-Benzylidene-2,4-pentanedione
SpectraBase Compound ID JmTYa2OCaXo
InChI InChI=1S/C12H12O2/c1-9(13)12(10(2)14)8-11-6-4-3-5-7-11/h3-8H,1-2H3
InChIKey NYRGMNMVISROGJ-UHFFFAOYSA-N
Mol Weight 188.23 g/mol
Molecular Formula C12H12O2
Exact Mass 188.08373 g/mol
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D50JWfdn6L2
Name 3-BENZYLIDENE-2,4-PENTANEDIONE
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12O2
InChI InChI=1S/C12H12O2/c1-9(13)12(10(2)14)8-11-6-4-3-5-7-11/h3-8H,1-2H3
InChIKey NYRGMNMVISROGJ-UHFFFAOYSA-N
Molecular Weight 188.23
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms 2,4-PENTANEDIONE, 3-BENZYLIDENE-,
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