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3-Cyano-4-imino-2-morpholino-4H-pyrimido[2,1-b][1,3]benzothiazole
SpectraBase Compound ID DiUFqJIlFUg
InChI InChI=1S/C15H13N5OS/c16-9-10-13(17)20-11-3-1-2-4-12(11)22-15(20)18-14(10)19-5-7-21-8-6-19/h1-4,17H,5-8H2
InChIKey JICLEXHXTBDPQH-UHFFFAOYSA-N
Mol Weight 311.36 g/mol
Molecular Formula C15H13N5OS
Exact Mass 311.084081 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2JirBkRhQW
Name 3-Cyano-4-imino-2-morpholino-4H-pyrimido[2,1-b][1,3]benzothiazole
Appearance Yellow powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H13N5OS
InChI InChI=1S/C15H13N5OS/c16-9-10-13(17)20-11-3-1-2-4-12(11)22-15(20)18-14(10)19-5-7-21-8-6-19/h1-4,17H,5-8H2
InChIKey JICLEXHXTBDPQH-UHFFFAOYSA-N
Instrument Name FT VG-7070 H
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0007.a22
Molecular Weight 311.363 g/mol
SMILES N=C1C(=C(N=C2N1c1c(S2)cccc1)N1CCOCC1)C#N
SPLASH splash10-0300-9866000000-a017ec0cc5604db15421
Source of Spectrum ARK-2006-195-7a
Wiley ID 1871145