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13-Methoxy-6-(p-tolylsulfonyl)-2-thia-6-aza[7]metacyclophane
SpectraBase Compound ID DStxOBtuC5N
InChI InChI=1S/C19H23NO3S2/c1-15-7-9-18(10-8-15)25(21,22)20-11-4-12-24-14-17-6-3-5-16(13-20)19(17)23-2/h3,5-10H,4,11-14H2,1-2H3
InChIKey RGDQXURDBOZWNC-UHFFFAOYSA-N
Mol Weight 377.52 g/mol
Molecular Formula C19H23NO3S2
Exact Mass 377.111936 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AWK0DMe4IYT
Name 13-Methoxy-6-(p-tolylsulfonyl)-2-thia-6-aza[7]metacyclophane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H23NO3S2
InChI InChI=1S/C19H23NO3S2/c1-15-7-9-18(10-8-15)25(21,22)20-11-4-12-24-14-17-6-3-5-16(13-20)19(17)23-2/h3,5-10H,4,11-14H2,1-2H3
InChIKey RGDQXURDBOZWNC-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cber.19941270427
Molecular Weight 377.517 g/mol
SMILES c1cc2c(c(c1)CSCCCN(C2)S(c1ccc(cc1)C)(=O)=O)OC
SPLASH splash10-00kr-1709000000-b55a5d3081dcd66c7532
Source of Spectrum K-127-764-6b
Wiley ID 1793120