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3-Methyl-2-pentanone
SpectraBase Compound ID ATcLOBcmBCr
InChI InChI=1S/C6H12O/c1-4-5(2)6(3)7/h5H,4H2,1-3H3
InChIKey UIHCLUNTQKBZGK-UHFFFAOYSA-N
Mol Weight 100.16 g/mol
Molecular Formula C6H12O
Exact Mass 100.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Q7BVSwMXrP
Name 2-Pentanone, 3-methyl-
Alternate Name(s) 3-Methyl-2-pentanone 3-Methylpentan-2-one Methyl 1-methylpropyl ketone Methyl sec-butyl ketone sec-Butyl Methyl ketone sec-C4H9COCH3 EINECS 209-282-1 NSC 66492
CAS Registry Number 565-61-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H12O
InChI InChI=1S/C6H12O/c1-4-5(2)6(3)7/h5H,4H2,1-3H3
InChIKey UIHCLUNTQKBZGK-UHFFFAOYSA-N
Molecular Weight 100.161 g/mol
SMILES CC(C(C)=O)CC
SPLASH splash10-0006-9000000000-9d778f1738e045e5b117
Wiley ID 1494140