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methyl (3S)-2-(chloroacetyl)-1,1-dimethyl-2,3,4,9-tetrahydro-1H-beta-carboline-3-carboxylate

View entire compound with spectra: 1 NMR

methyl (3S)-2-(chloroacetyl)-1,1-dimethyl-2,3,4,9-tetrahydro-1H-beta-carboline-3-carboxylate
SpectraBase Compound ID CXyDwHIAd3N
InChI InChI=1S/C17H19ClN2O3/c1-17(2)15-11(10-6-4-5-7-12(10)19-15)8-13(16(22)23-3)20(17)14(21)9-18/h4-7,13,19H,8-9H2,1-3H3
InChIKey YTNZJAMWMLPAQY-UHFFFAOYSA-N
Mol Weight 334.8 g/mol
Molecular Formula C17H19ClN2O3
Exact Mass 334.10842 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AKG2W8ZK20a
Name methyl (3S)-2-(chloroacetyl)-1,1-dimethyl-2,3,4,9-tetrahydro-1H-beta-carboline-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/C17H19ClN2O3/c1-17(2)15-11(10-6-4-5-7-12(10)19-15)8-13(16(22)23-3)20(17)14(21)9-18/h4-7,13,19H,8-9H2,1-3H3
InChIKey YTNZJAMWMLPAQY-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_7110
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: 129719; Labnumber: EXP16Exi000123; SBI_ID: SBI-007113
Synonyms methyl 2-(chloroacetyl)-1,1-dimethyl-2,3,4,9-tetrahydro-1H-beta-carboline-3-carboxylate
Temperature 306 °C