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2-(methylsulfonyl)-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic acid

View entire compound with spectra: 1 NMR

2-(methylsulfonyl)-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic acid
SpectraBase Compound ID DxZFmbpFLCg
InChI InChI=1S/C11H13NO4S/c1-17(15,16)12-7-9-5-3-2-4-8(9)6-10(12)11(13)14/h2-5,10H,6-7H2,1H3,(H,13,14)
InChIKey IMIKNCFPHJZMGM-UHFFFAOYSA-N
Mol Weight 255.29 g/mol
Molecular Formula C11H13NO4S
Exact Mass 255.056529 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DboGp3egotU
Name 2-(methylsulfonyl)-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic acid
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 255.056529073 u
Formula C11H13NO4S
InChI InChI=1S/C11H13NO4S/c1-17(15,16)12-7-9-5-3-2-4-8(9)6-10(12)11(13)14/h2-5,10H,6-7H2,1H3,(H,13,14)
InChIKey IMIKNCFPHJZMGM-UHFFFAOYSA-N
Molecular Weight 255.288 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_4297
Solvent DMSO-d6
Source Vendor ID: NMR/12309146