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2-(3-Benzothiazol-6-yl-propyl)-isoindole-1,3-dione

View entire compound with spectra: 1 MS (GC)

2-(3-Benzothiazol-6-yl-propyl)-isoindole-1,3-dione
SpectraBase Compound ID 344YlD4pQbb
InChI InChI=1S/C18H14N2O2S/c21-17-13-5-1-2-6-14(13)18(22)20(17)9-3-4-12-7-8-15-16(10-12)23-11-19-15/h1-2,5-8,10-11H,3-4,9H2
InChIKey LLVSMTHZLDWFJB-UHFFFAOYSA-N
Mol Weight 322.38 g/mol
Molecular Formula C18H14N2O2S
Exact Mass 322.077599 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JkdRwtSPOfd
Name 2-(3-Benzothiazol-6-yl-propyl)-isoindole-1,3-dione
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H14N2O2S
InChI InChI=1S/C18H14N2O2S/c21-17-13-5-1-2-6-14(13)18(22)20(17)9-3-4-12-7-8-15-16(10-12)23-11-19-15/h1-2,5-8,10-11H,3-4,9H2
InChIKey LLVSMTHZLDWFJB-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 322.382 g/mol
SMILES c12c(cccc2)C(N(C1=O)CCCc1ccc2c(c1)scn2)=O
SPLASH splash10-0229-0905000000-82ff94fadf5756ad0084
Source of Spectrum RS50575B
Wiley ID 1842045