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6-Acetamido-2,2-dimethyl-4-(1-oxo-2-cyclopenten-2-yl)-3,4-dihydro-2H-1,4-benzothiazine
SpectraBase Compound ID 1o1vmdFHFFI
InChI InChI=1S/C17H20N2O2S/c1-11(20)18-12-7-8-16-14(9-12)19(10-17(2,3)22-16)13-5-4-6-15(13)21/h5,7-9H,4,6,10H2,1-3H3,(H,18,20)
InChIKey ZEMABUVITVCSDN-UHFFFAOYSA-N
Mol Weight 316.42 g/mol
Molecular Formula C17H20N2O2S
Exact Mass 316.124549 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4DSwYI62kjC
Name 6-Acetamido-2,2-dimethyl-4-(1-oxo-2-cyclopenten-2-yl)-3,4-dihydro-2H-1,4-benzothiazine
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20N2O2S
InChI InChI=1S/C17H20N2O2S/c1-11(20)18-12-7-8-16-14(9-12)19(10-17(2,3)22-16)13-5-4-6-15(13)21/h5,7-9H,4,6,10H2,1-3H3,(H,18,20)
InChIKey ZEMABUVITVCSDN-UHFFFAOYSA-N
Instrument Name HP 6890-5973
Ionization Type EI
Literature Reference DOI 10.1021/jm400435a
Molecular Weight 316.419 g/mol
SMILES N(c1cc2N(C=3C(=O)CCC3)CC(Sc2cc1)(C)C)C(C)=O
SPLASH splash10-01b9-0095000000-beacdf190a504c33f6bc
Source of Spectrum AF-56-4724-11
Wiley ID 1854538