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4-[2-(methylamino)ethyl]pyrocatechol, diisobutyrate, hydrochloride
SpectraBase Compound ID 5khaU829yio
InChI InChI=1S/C17H25NO4.ClH/c1-11(2)16(19)21-14-7-6-13(8-9-18-5)10-15(14)22-17(20)12(3)4;/h6-7,10-12,18H,8-9H2,1-5H3;1H
InChIKey ALIXRWKJZYLBJI-UHFFFAOYSA-N
Mol Weight 343.85 g/mol
Molecular Formula C17H26ClNO4
Exact Mass 343.155036 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID C8IAtvBHLF1
Name 4-[2-(METHYLAMINO)ETHYL]PYROCATECHOL, DIISOBUTYRATE,HYDROCHLORIDE
Source of Sample C. Casagrande, Simes S.p.A., Cormano, Italy
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H25NO4 HCl
InChI InChI=1S/C17H25NO4.ClH/c1-11(2)16(19)21-14-7-6-13(8-9-18-5)10-15(14)22-17(20)12(3)4;/h6-7,10-12,18H,8-9H2,1-5H3;1H
InChIKey ALIXRWKJZYLBJI-UHFFFAOYSA-N
Melting Point 135-138C
Molecular Weight 343.85
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms PYROCATECHOL, 4-/2-/METHYLAMINO/ETHYL/-, DIISOBUTYRATE, HYDROCHLORIDE IBOPAMINE, HYDROCHLORIDE