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Tert-butyl 5-oxopentanoate

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

Tert-butyl 5-oxopentanoate
SpectraBase Compound ID IHdPsVENyBp
InChI InChI=1S/C9H16O3/c1-9(2,3)12-8(11)6-4-5-7-10/h7H,4-6H2,1-3H3
InChIKey OJLCOAYTPHMGTM-UHFFFAOYSA-N
Mol Weight 172.22 g/mol
Molecular Formula C9H16O3
Exact Mass 172.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID NBYNCgApxb
Name tert-Butyl 5-oxopentanoate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O3
InChI InChI=1S/C9H16O3/c1-9(2,3)12-8(11)6-4-5-7-10/h7H,4-6H2,1-3H3
InChIKey OJLCOAYTPHMGTM-UHFFFAOYSA-N
Literature Reference DOI 10.1002/asia.200700288
Molecular Weight 172.224 g/mol
SMILES C(=O)(OC(C)(C)C)CCCC=O
SPLASH splash10-0a4l-9000000000-68e5972c84179e4da48a
Source of Spectrum CAJ-3-314-8
Synonyms 5-Oxopentanoic acid tert-butyl ester tert-Butyl 5-oxidanylidenepentanoate
Wiley ID 1774555