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2,2-Dimethylpropanoic acid 2-methylpropyl ester
SpectraBase Compound ID 6pyXrH9rT2c
InChI InChI=1S/C9H18O2/c1-7(2)6-11-8(10)9(3,4)5/h7H,6H2,1-5H3
InChIKey IFVLZKSUYNTRHJ-UHFFFAOYSA-N
Mol Weight 158.24 g/mol
Molecular Formula C9H18O2
Exact Mass 158.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CPMYYXaidb6
Name 2,2-Dimethylpropanoic acid 2-methylpropyl ester
Alternate Name(s) 2,2-Dimethylpropionic acid isobutyl ester 2-Methylpropyl 2,2-dimethylpropanoate isobutyl 2,2-dimethylpropanoate Isobutyl pivalate Pivalic acid, 2-methylpropyl ester
CAS Registry Number 5129-38-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H18O2
InChI InChI=1S/C9H18O2/c1-7(2)6-11-8(10)9(3,4)5/h7H,6H2,1-5H3
InChIKey IFVLZKSUYNTRHJ-UHFFFAOYSA-N
Molecular Weight 158.241 g/mol
SMILES C(C(C)(C)C)(OCC(C)C)=O
SPLASH splash10-0a4i-9100000000-ccb0a2980b09cf8102e8
Source of Spectrum NP-1-8748-0
Wiley ID 1099789