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1,3-Butanedione, 2-sec-butyl-1-phenyl-
SpectraBase Compound ID BuBRTHTIAJD
InChI InChI=1S/C14H18O2/c1-4-10(2)13(11(3)15)14(16)12-8-6-5-7-9-12/h5-10,13H,4H2,1-3H3
InChIKey KYIVSKWOJCLODL-UHFFFAOYSA-N
Mol Weight 218.3 g/mol
Molecular Formula C14H18O2
Exact Mass 218.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F536p4JVOQ4
Name 1,3-Butanedione, 2-sec-butyl-1-phenyl-
Alternate Name(s) 2-Sec-butyl-1-phenyl-1,3-butanedione 1-Phenyl-2-sec-butyl-1,3-butanedione 1-Phenyl-2-sec-butyl-butane-1,3-dione 2-Butan-2-yl-1-phenyl-butane-1,3-dione
CAS Registry Number 10225-40-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O2
InChI InChI=1S/C14H18O2/c1-4-10(2)13(11(3)15)14(16)12-8-6-5-7-9-12/h5-10,13H,4H2,1-3H3
InChIKey KYIVSKWOJCLODL-UHFFFAOYSA-N
Molecular Weight 218.296 g/mol
SMILES CCC(C)C(C(C)=O)C(c1ccccc1)=O
SPLASH splash10-0bt9-3900000000-cc696eaebf9f22779d26
Source of Spectrum T-66-1287-0
Wiley ID 1217899