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5a-Hydroxy-2-(t-butyl)-5a,6,7,8,9,9a-hexahydro-4H-pyrimido[2,1-b]benzothiazol-4-one
SpectraBase Compound ID Jx3CDjFHLKx
InChI InChI=1S/C14H20N2O2S/c1-13(2,3)9-8-11(17)16-12(15-9)19-10-6-4-5-7-14(10,16)18/h8,10,18H,4-7H2,1-3H3
InChIKey GVQVSNWUXNSNOW-UHFFFAOYSA-N
Mol Weight 280.39 g/mol
Molecular Formula C14H20N2O2S
Exact Mass 280.124549 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H81uggQUZsn
Name 5a-Hydroxy-2-(t-butyl)-5a,6,7,8,9,9a-hexahydro-4H-pyrimido[2,1-b]benzothiazol-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20N2O2S
InChI InChI=1S/C14H20N2O2S/c1-13(2,3)9-8-11(17)16-12(15-9)19-10-6-4-5-7-14(10,16)18/h8,10,18H,4-7H2,1-3H3
InChIKey GVQVSNWUXNSNOW-UHFFFAOYSA-N
Molecular Weight 280.386 g/mol
SMILES OC12N3C(SC2CCCC1)=NC(=CC3=O)C(C)(C)C
SPLASH splash10-015i-2290000000-871f552950ce68d14eba
Source of Spectrum U-1994-180-16
Synonyms 2-tert-Butyl-5a-hydroxy-5a,6,7,8,9,9a-hexahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
Wiley ID 765695