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7,8-Dimethyl-4-pentyl-2H-pyrimido[2,1-b]benzothiazol-2-one
SpectraBase Compound ID HxrRVlsSaFP
InChI InChI=1S/C17H20N2OS/c1-4-5-6-7-13-10-16(20)18-17-19(13)14-8-11(2)12(3)9-15(14)21-17/h8-10H,4-7H2,1-3H3
InChIKey LWIGTVWSAOMZHI-UHFFFAOYSA-N
Mol Weight 300.42 g/mol
Molecular Formula C17H20N2OS
Exact Mass 300.129634 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8uLIKpdk3xj
Name 7,8-Dimethyl-4-pentyl-2H-pyrimido[2,1-b]benzothiazol-2-one
Appearance Colourless needles
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 300.129634445 u
Formula C17H20N2OS
InChI InChI=1S/C17H20N2OS/c1-4-5-6-7-13-10-16(20)18-17-19(13)14-8-11(2)12(3)9-15(14)21-17/h8-10H,4-7H2,1-3H3
InChIKey LWIGTVWSAOMZHI-UHFFFAOYSA-N
Instrument Name Jeol JMS-SX102
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0004.f12
Quality 8
SMILES CC=1C(=CC=2N3C(SC2C1)=NC(C=C3CCCCC)=O)C
SPLASH splash10-0udi-0195000000-d7200654452e4ad27c6e
Source of Spectrum ARK-2003-111-7b (DOI: 10.3998/ark.5550190.0004.f12)
Wiley ID 1899842