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Isoquinoline, 2-[[2-ethoxy-5-(1-methylethyl)phenyl]sulfonyl]-1,2,3,4-tetrahydro-
SpectraBase Compound ID JIm3CIh4Xa2
InChI InChI=1S/C20H25NO3S/c1-4-24-19-10-9-17(15(2)3)13-20(19)25(22,23)21-12-11-16-7-5-6-8-18(16)14-21/h5-10,13,15H,4,11-12,14H2,1-3H3
InChIKey JXTWMLNKYDLYAD-UHFFFAOYSA-N
Mol Weight 359.48 g/mol
Molecular Formula C20H25NO3S
Exact Mass 359.155515 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IC2oviXEjGm
Name Isoquinoline, 2-[[2-ethoxy-5-(1-methylethyl)phenyl]sulfonyl]-1,2,3,4-tetrahydro-
Alternate Name(s) 2-(2-Ethoxy-5-propan-2-ylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline 2-(2-Ethoxy-5-propan-2-yl-phenyl)sulfonyl-3,4-dihydro-1H-isoquinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H25NO3S
InChI InChI=1S/C20H25NO3S/c1-4-24-19-10-9-17(15(2)3)13-20(19)25(22,23)21-12-11-16-7-5-6-8-18(16)14-21/h5-10,13,15H,4,11-12,14H2,1-3H3
InChIKey JXTWMLNKYDLYAD-UHFFFAOYSA-N
Molecular Weight 359.484 g/mol
SMILES c1cc2CCN(S(c3cc(C(C)C)ccc3OCC)(=O)=O)Cc2cc1
SPLASH splash10-001i-3900000000-d510bf92e52931c30d54
Source of Spectrum IY-1-4467-1
Wiley ID 1652654