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1H-2-benzopyran-1,3(4H)-dione, 4-[2-[3-(1-methylethyl)-2(3H)-benzothiazolylidene]ethylidene]-
SpectraBase Compound ID GRRt6AnxRig
InChI InChI=1S/C21H17NO3S/c1-13(2)22-17-9-5-6-10-18(17)26-19(22)12-11-16-14-7-3-4-8-15(14)20(23)25-21(16)24/h3-13H,1-2H3/b16-11-,19-12-
InChIKey KWEUGQRECVHEMD-YETRDSHKSA-N
Mol Weight 363.43 g/mol
Molecular Formula C21H17NO3S
Exact Mass 363.092915 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HzDYiQHvrex
Name 1H-2-benzopyran-1,3(4H)-dione, 4-[2-[3-(1-methylethyl)-2(3H)-benzothiazolylidene]ethylidene]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H17NO3S
InChI InChI=1S/C21H17NO3S/c1-13(2)22-17-9-5-6-10-18(17)26-19(22)12-11-16-14-7-3-4-8-15(14)20(23)25-21(16)24/h3-13H,1-2H3/b16-11-,19-12-
InChIKey KWEUGQRECVHEMD-YETRDSHKSA-N
Molecular Weight 363.431 g/mol
SMILES CC(C)N1\C(Sc2ccccc12)=C\C=C/1C(=O)OC(=O)c2ccccc12
SPLASH splash10-01ta-1194000000-7df48593794156bc5f4a
Source of Spectrum JX-2015-3-1368
Synonyms (Z)-4-((Z)-2-(3-isopropylbenzo[d]thiazol-2(3H)-ylidene)ethylidene)isochroman-1,3-dione (4Z)-4-[(2Z)-2-(3-propan-2-yl-1,3-benzothiazol-2-ylidene)ethylidene]-3,4-dihydro-1H-2-benzopyran-1,3-dione (4Z)-4-[(2Z)-2-(3-isopropyl-1,3-benzothiazol-2-ylidene)ethylidene]isochromane-1,3-dione (4Z)-4-[(2Z)-2-(3-propan-2-yl-1,3-benzothiazol-2-ylidene)ethylidene]isochromene-1,3-dione
Wiley ID 1724858