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(E)-methyl 1-acetyl-2-(benzo[d]thiazol-5-ylmethylene)cycolpentanecarboxylate
SpectraBase Compound ID LQDaauf0fvv
InChI InChI=1S/C17H17NO3S/c1-11(19)17(16(20)21-2)7-3-4-13(17)8-12-5-6-15-14(9-12)18-10-22-15/h5-6,8-10H,3-4,7H2,1-2H3/b13-8+
InChIKey BQZZERCVAHCDJP-MDWZMJQESA-N
Mol Weight 315.39 g/mol
Molecular Formula C17H17NO3S
Exact Mass 315.092915 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3PqJRojiWEo
Name (E)-methyl 1-acetyl-2-(benzo[d]thiazol-5-ylmethylene)cycolpentanecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17NO3S
InChI InChI=1S/C17H17NO3S/c1-11(19)17(16(20)21-2)7-3-4-13(17)8-12-5-6-15-14(9-12)18-10-22-15/h5-6,8-10H,3-4,7H2,1-2H3/b13-8+
InChIKey BQZZERCVAHCDJP-MDWZMJQESA-N
Literature Reference DOI 10.1002/adsc.201600175
Molecular Weight 315.387 g/mol
SMILES C1(\C(CCC1)=C\c1cc2c(cc1)scn2)(C(=O)C)C(=O)OC
SPLASH splash10-006x-4190000000-e2421226fc348001daa7
Source of Spectrum ASC-358-1820/SM10-28
Synonyms Methyl (E)-1-acetyl-2-(benzo[d]thiazol-5-ylmethylene)cyclopentane-1-carboxylate
Wiley ID 1807402