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N-(3-methoxypropyl)benzo[kl]thioxanthene-3,4-dicarboximide

View entire compound with spectra: 1 NMR, 2 FTIR, and 1 Raman

N-(3-methoxypropyl)benzo[kl]thioxanthene-3,4-dicarboximide
SpectraBase Compound ID 7wMfnNXZhai
InChI InChI=1S/C22H17NO3S/c1-26-12-4-11-23-21(24)15-8-7-14-13-5-2-3-6-17(13)27-18-10-9-16(22(23)25)19(15)20(14)18/h2-3,5-10H,4,11-12H2,1H3
InChIKey GIEARNNTYXJWQQ-UHFFFAOYSA-N
Mol Weight 375.44 g/mol
Molecular Formula C22H17NO3S
Exact Mass 375.092915 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID LmPRdKWvHHM
Name N-(3-Methoxypropyl)benzo[kl]thioxanthene-3,4-dicarboximide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 375.092914582 u
Formula C22H17NO3S
InChI InChI=1S/C22H17NO3S/c1-26-12-4-11-23-21(24)15-8-7-14-13-5-2-3-6-17(13)27-18-10-9-16(22(23)25)19(15)20(14)18/h2-3,5-10H,4,11-12H2,1H3
InChIKey GIEARNNTYXJWQQ-UHFFFAOYSA-N
Molecular Weight 375.442 g/mol
SMILES C=12C=CC=CC1SC1=CC=C3C(N(C(C4=CC=C2C1=C34)=O)CCCOC)=O
Spectrum/Structure Validation Score (Raman) 0.926607