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2-Propyl-acetoacetic acid, ethyl ester
SpectraBase Compound ID 3ZbIVJ4FNK7
InChI InChI=1S/C9H16O3/c1-4-6-8(7(3)10)9(11)12-5-2/h8H,4-6H2,1-3H3
InChIKey VHOACUZAQKMOEQ-UHFFFAOYSA-N
Mol Weight 172.22 g/mol
Molecular Formula C9H16O3
Exact Mass 172.109944 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KYPwmTWIqgi
Name 2-PROPYLACETOACETIC ACID, ETHYL ESTER
Source of Sample Eastman Organic Chemicals, Rochester, New York
Boiling Point 95-98C/10mm
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O3
InChI InChI=1S/C9H16O3/c1-4-6-8(7(3)10)9(11)12-5-2/h8H,4-6H2,1-3H3
InChIKey VHOACUZAQKMOEQ-UHFFFAOYSA-N
Molecular Weight 172.23
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms ACETOACETIC ACID, 2-PROPYL-, ETHYL ESTER