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2,4-Nonanedione, 3-propyl-
SpectraBase Compound ID 2xZx0e09mgq
InChI InChI=1S/C12H22O2/c1-4-6-7-9-12(14)11(8-5-2)10(3)13/h11H,4-9H2,1-3H3
InChIKey VNEYOWRODFMBOV-UHFFFAOYSA-N
Mol Weight 198.31 g/mol
Molecular Formula C12H22O2
Exact Mass 198.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CKEvEsT4527
Name 2,4-Nonanedione, 3-propyl-
Alternate Name(s) 3-Propylnonane-2,4-dione
CAS Registry Number 113486-30-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O2
InChI InChI=1S/C12H22O2/c1-4-6-7-9-12(14)11(8-5-2)10(3)13/h11H,4-9H2,1-3H3
InChIKey VNEYOWRODFMBOV-UHFFFAOYSA-N
Molecular Weight 198.306 g/mol
SMILES C(C(=O)C)(C(=O)CCCCC)CCC
SPLASH splash10-0006-9200000000-d0f3dec7aaf0578c2046
Source of Spectrum O-22-497-13
Wiley ID 1195898