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2-octynoic acid, isopentyl ester

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2-octynoic acid, isopentyl ester
SpectraBase Compound ID 9dlK7UCzbcE
InChI InChI=1S/C13H22O2/c1-4-5-6-7-8-9-13(14)15-11-10-12(2)3/h12H,4-7,10-11H2,1-3H3
InChIKey OTJSOSMJTUKXJR-UHFFFAOYSA-N
Mol Weight 210.32 g/mol
Molecular Formula C13H22O2
Exact Mass 210.16198 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7n0Tm54SHJQ
Name 2-OCTYNOIC ACID, ISOPENTYL ESTER
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
CAS Registry Number 68555-60-2
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O2
InChI InChI=1S/C13H22O2/c1-4-5-6-7-8-9-13(14)15-11-10-12(2)3/h12H,4-7,10-11H2,1-3H3
InChIKey OTJSOSMJTUKXJR-UHFFFAOYSA-N
Molecular Weight 210.32
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Synonyms 2-OCTYNOIC ACID, ISOPENTYL ESTER