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erythro-ISOTHIOCYANIC ACID, 2-IODO-1-PROPYLPENTYL ESTER

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erythro-ISOTHIOCYANIC ACID, 2-IODO-1-PROPYLPENTYL ESTER
SpectraBase Compound ID FJEs5LaDLne
InChI InChI=1S/C9H16INS/c1-3-5-8(10)9(6-4-2)11-7-12/h8-9H,3-6H2,1-2H3
InChIKey JMZGQQFQMLWLQC-UHFFFAOYSA-N
Mol Weight 297.2 g/mol
Molecular Formula C9H16INS
Exact Mass 297.004816 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8jAC8gf7pTE
Name erythro-ISOTHIOCYANIC ACID, 2-IODO-1-PROPYLPENTYL ESTER
Source of Sample R. C. Cambie, G. D. Mayer, P. S. Rutledge J. Chem. Soc. Perkin Trans. I, 1981, 52
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16INS
InChI InChI=1S/C9H16INS/c1-3-5-8(10)9(6-4-2)11-7-12/h8-9H,3-6H2,1-2H3
InChIKey JMZGQQFQMLWLQC-UHFFFAOYSA-N
Molecular Weight 297.20
Solvent Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Not Reported
Synonyms ISOTHIOCYANIC ACID, 2-IODO- 1-PROPYLPENTYL ESTER, erythro-,