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7-(1,3-benzothiazol-2-ylmethyl)chromeno[4,3-b][1,5]benzothiazepin-6-one
SpectraBase Compound ID KRbdz9HcHOY
InChI InChI=1S/C24H14N2O2S2/c27-24-22-17(13-21-26-16-9-3-5-11-19(16)29-21)25-15-8-2-6-12-20(15)30-23(22)14-7-1-4-10-18(14)28-24/h1-12H,13H2
InChIKey WWJQPRYZISQIMV-UHFFFAOYSA-N
Mol Weight 426.51 g/mol
Molecular Formula C24H14N2O2S2
Exact Mass 426.04967 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B58bccISzBV
Name 7-(1,3-benzothiazol-2-ylmethyl)chromeno[4,3-b][1,5]benzothiazepin-6-one
Appearance Canary yellow crystals
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Formula C24H14N2O2S2
InChI InChI=1S/C24H14N2O2S2/c27-24-22-17(13-21-26-16-9-3-5-11-19(16)29-21)25-15-8-2-6-12-20(15)30-23(22)14-7-1-4-10-18(14)28-24/h1-12H,13H2
InChIKey WWJQPRYZISQIMV-UHFFFAOYSA-N
Instrument Name Shimadzu GC-2010
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3811
Molecular Weight 426.508 g/mol
SMILES c1ccc2c(c1)C1=C(C(O2)=O)C(=Nc2c(S1)cccc2)Cc1sc2c(n1)cccc2
SPLASH splash10-002o-2941200000-bfe4a6ff638226cde7af
Source of Spectrum Y-57-722-16
Wiley ID 1860028