ethyl (1S,2S,3S)-3-cyano-1-(2,2-dimethylpropanoyl)-2-phenyl-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-3-carboxylate

SpectraBase Compound ID	ITH1WVH6qSM
InChI	InChI=1S/C27H28N2O3/c1-5-32-25(31)27(17-28)21-16-15-18-11-9-10-14-20(18)29(21)23(24(30)26(2,3)4)22(27)19-12-7-6-8-13-19/h6-16,21-23H,5H2,1-4H3
InChIKey	ZBPYCSQAPDWGIA-UHFFFAOYSA-N Google Search
Mol Weight	428.53 g/mol
Molecular Formula	C27H28N2O3
Exact Mass	428.209993 g/mol

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SpectraBase Spectrum ID	GQD9yVikRa
Name	ethyl (1S,2S,3S)-3-cyano-1-(2,2-dimethylpropanoyl)-2-phenyl-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-3-carboxylate
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C27H28N2O3/c1-5-32-25(31)27(17-28)21-16-15-18-11-9-10-14-20(18)29(21)23(24(30)26(2,3)4)22(27)19-12-7-6-8-13-19/h6-16,21-23H,5H2,1-4H3
InChIKey	ZBPYCSQAPDWGIA-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_1883
Owner	Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State	soluted
Solvent	DMSO-d6
Source File Reference	VendorID: C99364; Labnumber: NNA05-109; SBI_ID: SBI-001885
Synonyms	ethyl 3-cyano-1-(2,2-dimethylpropanoyl)-2-phenyl-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-3-carboxylate
Temperature	318 °C