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4-Benzothiazol-2-yl-4-tert-butylamino-1-phenoxy-but-3-en-2-one
SpectraBase Compound ID 2jVb5FbwHfO
InChI InChI=1S/C21H22N2O2S/c1-21(2,3)23-18(20-22-17-11-7-8-12-19(17)26-20)13-15(24)14-25-16-9-5-4-6-10-16/h4-13,23H,14H2,1-3H3
InChIKey KYAIZWGSHLIDNW-UHFFFAOYSA-N
Mol Weight 366.48 g/mol
Molecular Formula C21H22N2O2S
Exact Mass 366.140199 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ej2rOA4ZOe8
Name 4-Benzothiazol-2-yl-4-tert-butylamino-1-phenoxy-but-3-en-2-one
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22N2O2S
InChI InChI=1S/C21H22N2O2S/c1-21(2,3)23-18(20-22-17-11-7-8-12-19(17)26-20)13-15(24)14-25-16-9-5-4-6-10-16/h4-13,23H,14H2,1-3H3
InChIKey KYAIZWGSHLIDNW-UHFFFAOYSA-N
Instrument Name Agilent Technologies 6850 Series II-5973 Network
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0010.e27
Molecular Weight 366.479 g/mol
Reported Formula C21H22N2O2S
SMILES N(C(c1sc2c(n1)cccc2)=CC(COc1ccccc1)=O)C(C)(C)C
SPLASH splash10-0pb9-0191000000-323050d84e5b460e98b3
Source of Spectrum ARK-2009-334-3b
Wiley ID 1869913