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8-(4-(Methylthio)phenoxy)-1-morpholinooctane-1,2-dione
SpectraBase Compound ID HAdk9KqWfEA
InChI InChI=1S/C19H27NO4S/c1-25-17-9-7-16(8-10-17)24-13-5-3-2-4-6-18(21)19(22)20-11-14-23-15-12-20/h7-10H,2-6,11-15H2,1H3
InChIKey VOYCEGQMZLNLNC-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 HaFZX7Y8to2
Name 8-(4-(Methylthio)phenoxy)-1-morpholinooctane-1,2-dione
Appearance Colorless oil
Carrier Gas Argon
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 365.166079523 u
Formula C19H27NO4S
InChI InChI=1S/C19H27NO4S/c1-25-17-9-7-16(8-10-17)24-13-5-3-2-4-6-18(21)19(22)20-11-14-23-15-12-20/h7-10H,2-6,11-15H2,1H3
InChIKey VOYCEGQMZLNLNC-UHFFFAOYSA-N
Instrument Name AMD 402
Ionization Type EI
Literature Reference DOI 10.1002/anie.202200062
Molecular Weight 365.488 g/mol
Quality 189
Reported Formula C19H27NO4S
SMILES C(C(CCCCCCOC1=CC=C(C=C1)SC)=O)(=O)N1CCOCC1
SPLASH splash10-00kf-5903000000-d220f9436a926af4ca16
Source of Spectrum ACI-61-SM28-5e (DOI: 10.1002/anie.202200062)
Thin-Layer Chromatography 0.2 (pentane/EA, 5:1)
Wiley ID 1897610