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3-Cyano-4-imino-2-morpholino-8-methyl-4H-pyrimido[2,1-b][1,3]benzothiazole
SpectraBase Compound ID y5aRtzu0xi
InChI InChI=1S/C16H15N5OS/c1-10-2-3-12-13(8-10)23-16-19-15(20-4-6-22-7-5-20)11(9-17)14(18)21(12)16/h2-3,8,18H,4-7H2,1H3
InChIKey WDCUBHVBPXLKBM-UHFFFAOYSA-N
Mol Weight 325.39 g/mol
Molecular Formula C16H15N5OS
Exact Mass 325.099731 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KIfRTC0aDfz
Name 3-Cyano-4-imino-2-morpholino-8-methyl-4H-pyrimido[2,1-b][1,3]benzothiazole
Appearance Yellow powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15N5OS
InChI InChI=1S/C16H15N5OS/c1-10-2-3-12-13(8-10)23-16-19-15(20-4-6-22-7-5-20)11(9-17)14(18)21(12)16/h2-3,8,18H,4-7H2,1H3
InChIKey WDCUBHVBPXLKBM-UHFFFAOYSA-N
Instrument Name FT VG-7070 H
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0007.a22
Molecular Weight 325.390 g/mol
SMILES N=C1C(=C(N=C2N1c1c(S2)cc(cc1)C)N1CCOCC1)C#N
SPLASH splash10-000j-3393000000-1b5b9068caf45487ed56
Source of Spectrum ARK-2006-196-7d
Wiley ID 1871146