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Perhydroisoquinolin-3-acetic acid, 2-(4-methylphenyl)sulfonyl-, methyl ester

View entire compound with spectra: 2 MS (GC)

Perhydroisoquinolin-3-acetic acid, 2-(4-methylphenyl)sulfonyl-, methyl ester
SpectraBase Compound ID B3DqqfnhULi
InChI InChI=1S/C19H27NO4S/c1-14-7-9-18(10-8-14)25(22,23)20-13-16-6-4-3-5-15(16)11-17(20)12-19(21)24-2/h7-10,15-17H,3-6,11-13H2,1-2H3
InChIKey UMLPOYGTNIGRLX-UHFFFAOYSA-N
Mol Weight 365.49 g/mol
Molecular Formula C19H27NO4S
Exact Mass 365.16608 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DMaicbJoelr
Name
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C19H27NO4S
InChI InChI=1S/C19H27NO4S/c1-14-7-9-18(10-8-14)25(22,23)20-13-16-6-4-3-5-15(16)11-17(20)12-19(21)24-2/h7-10,15-17H,3-6,11-13H2,1-2H3
InChIKey UMLPOYGTNIGRLX-UHFFFAOYSA-N
Molecular Weight 365.1654
SMILES C12CC(N(S(c3ccc(C)cc3)(=O)=O)CC2CCCC1)CC(OC)=O
SPLASH splash10-01ox-9670000000-ec1e46f2b26d1f1a3c58
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany