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1-hexamethyleneimineacetic acid, ester with 3,3-diphenyl-4-(2-hydroxyethyl)-1-isopropyl-2-pyrrolidinone
SpectraBase Compound ID JcgpHrrWNq7
InChI InChI=1S/C29H38N2O3/c1-23(2)31-21-26(17-20-34-27(32)22-30-18-11-3-4-12-19-30)29(28(31)33,24-13-7-5-8-14-24)25-15-9-6-10-16-25/h5-10,13-16,23,26H,3-4,11-12,17-22H2,1-2H3
InChIKey IGVPTXQFXZSQIO-UHFFFAOYSA-N
Mol Weight 462.6 g/mol
Molecular Formula C29H38N2O3
Exact Mass 462.288243 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KB9eSfK053a
Name 1-hexamethyleneimineacetic acid, ester with 3,3-diphenyl-4-(2-hydroxyethyl)-1-isopropyl-2-pyrrolidinone
Source of Sample C. D. Lunsford, A. H. Robins Company, Inc., Richmond, Virginia
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H38N2O3
InChI InChI=1S/C29H38N2O3/c1-23(2)31-21-26(17-20-34-27(32)22-30-18-11-3-4-12-19-30)29(28(31)33,24-13-7-5-8-14-24)25-15-9-6-10-16-25/h5-10,13-16,23,26H,3-4,11-12,17-22H2,1-2H3
InChIKey IGVPTXQFXZSQIO-UHFFFAOYSA-N
Instrument Name Varian A-60
Literature Reference JMCH 10, 214(1967)
Sadtler NMR Number 5457M
Solvent CDCl3
Synonyms 1-HEXAMETHYLENEIMINEACETIC ACID, ESTER WITH 3,3-DIPHENYL-4-/2-HYDROXY- ETHYL/-1-ISOPROPYL-2-PYRROLIDINONE