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4-Ethoxy-phenylisothiocyanate

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4-Ethoxy-phenylisothiocyanate
SpectraBase Compound ID A1T7QWDpruQ
InChI InChI=1S/C9H9NOS/c1-2-11-9-5-3-8(4-6-9)10-7-12/h3-6H,2H2,1H3
InChIKey REEKOMRZYJXXNR-UHFFFAOYSA-N
Mol Weight 179.24 g/mol
Molecular Formula C9H9NOS
Exact Mass 179.040485 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7Tj2xPS2tC4
Name ISOTHIOCYANIC ACID, p-ETHOXYPHENYL ESTER
Source of Sample R. G. Jones, G. Allen Org. Magn. Resonance 19, 196 (1982)
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9NOS
InChI InChI=1S/C9H9NOS/c1-2-11-9-5-3-8(4-6-9)10-7-12/h3-6H,2H2,1H3
InChIKey REEKOMRZYJXXNR-UHFFFAOYSA-N
Molecular Weight 179.24
Solvent Chloroform-d; Reference=TMS; Temperature=306 K Spectrometer= Jeol FX-60
Synonyms ISOTHIOCYANIC ACID, P-ETHOXYPHENYL ESTER