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2-[3-Butyl-4-oxo-2-(phenylimino)-1,3-thiazinan-5-yl]-acetic Acid
SpectraBase Compound ID FBlI69Pop4G
InChI InChI=1S/C16H20N2O3S/c1-2-3-9-18-15(21)12(10-14(19)20)11-22-16(18)17-13-7-5-4-6-8-13/h4-8,12H,2-3,9-11H2,1H3,(H,19,20)/b17-16+
InChIKey NMJNAFCMJJGACL-WUKNDPDISA-N
Mol Weight 320.41 g/mol
Molecular Formula C16H20N2O3S
Exact Mass 320.119464 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BTNsVRt52bs
Name 2-[3-Butyl-4-oxo-2-(phenylimino)-1,3-thiazinan-5-yl]-acetic Acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20N2O3S
InChI InChI=1S/C16H20N2O3S/c1-2-3-9-18-15(21)12(10-14(19)20)11-22-16(18)17-13-7-5-4-6-8-13/h4-8,12H,2-3,9-11H2,1H3,(H,19,20)/b17-16+
InChIKey NMJNAFCMJJGACL-WUKNDPDISA-N
Molecular Weight 320.407 g/mol
SMILES OC(CC1C(N(\C(SC1)=N/c1ccccc1)CCCC)=O)=O
SPLASH splash10-0059-9500000000-d9ebcfeb42578cdb8504
Source of Spectrum H-92-1906-4f
Wiley ID 1693680