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2-{[(4-methyl-2-pyrimidinyl)sulfanyl]acetyl}-1,2,3,4-tetrahydroisoquinoline
SpectraBase Compound ID 58YoRbwlU2z
InChI InChI=1S/C16H17N3OS/c1-12-6-8-17-16(18-12)21-11-15(20)19-9-7-13-4-2-3-5-14(13)10-19/h2-6,8H,7,9-11H2,1H3
InChIKey MGVXMZCVFWESNH-UHFFFAOYSA-N
Mol Weight 299.39 g/mol
Molecular Formula C16H17N3OS
Exact Mass 299.109233 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5NBK0Vo3EYQ
Name 2-{[(4-methyl-2-pyrimidinyl)sulfanyl]acetyl}-1,2,3,4-tetrahydroisoquinoline
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 299.109233352 u
Formula C16H17N3OS
InChI InChI=1S/C16H17N3OS/c1-12-6-8-17-16(18-12)21-11-15(20)19-9-7-13-4-2-3-5-14(13)10-19/h2-6,8H,7,9-11H2,1H3
InChIKey MGVXMZCVFWESNH-UHFFFAOYSA-N
Molecular Weight 299.392 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_317
Solvent DMSO-d6
Source Vendor ID: NMR/12268031