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2,4-Dimethylpentanoic acid propan-2-yl ester
SpectraBase Compound ID DHLCtpKuDYj
InChI InChI=1S/C10H20O2/c1-7(2)6-9(5)10(11)12-8(3)4/h7-9H,6H2,1-5H3
InChIKey MAOCAULMSPEOLC-UHFFFAOYSA-N
Mol Weight 172.27 g/mol
Molecular Formula C10H20O2
Exact Mass 172.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2wBU4vXW7Rw
Name 2,4-Dimethylpentanoic acid propan-2-yl ester
CAS Registry Number 125427-68-1
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H20O2
InChI InChI=1S/C10H20O2/c1-7(2)6-9(5)10(11)12-8(3)4/h7-9H,6H2,1-5H3
InChIKey MAOCAULMSPEOLC-UHFFFAOYSA-N
Molecular Weight 172.268 g/mol
SMILES C(OC(C)C)(C(CC(C)C)C)=O
SPLASH splash10-0btr-9200000000-268e258c2a565c9e6a32
Source of Spectrum F-45-6192-29
Synonyms 2,4-Dimethylvaleric acid isopropyl ester isopropyl 2,4-dimethylpentanoate Propan-2-yl 2,4-dimethylpentanoate
Wiley ID 1169178