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Heptyl pivalate
SpectraBase Compound ID 3m4Ammbvj9V
InChI InChI=1S/C12H24O2/c1-5-6-7-8-9-10-14-11(13)12(2,3)4/h5-10H2,1-4H3
InChIKey VJQPQMJCZDBCEQ-UHFFFAOYSA-N
Mol Weight 200.32 g/mol
Molecular Formula C12H24O2
Exact Mass 200.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4yO0ycfTKZS
Name Heptyl pivalate
Alternate Name(s) 2,2-Dimethylpropanoic acid heptyl ester 2,2-Dimethylpropionic acid heptyl ester Heptyl 2,2-dimethylpropanoate Propanoic acid, 2,2-dimethyl-, heptyl ester
CAS Registry Number 17660-61-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H24O2
InChI InChI=1S/C12H24O2/c1-5-6-7-8-9-10-14-11(13)12(2,3)4/h5-10H2,1-4H3
InChIKey VJQPQMJCZDBCEQ-UHFFFAOYSA-N
Molecular Weight 200.322 g/mol
SMILES C(=O)(C(C)(C)C)OCCCCCCC
SPLASH splash10-0a4i-9000000000-fe014d2c9b860ee4cd80
Wiley ID 1493751