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N-(3,4-dimethoxyphenethyl)-4-(octylthio)naphthalimide

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

N-(3,4-dimethoxyphenethyl)-4-(octylthio)naphthalimide
SpectraBase Compound ID AOpMs5dCHZi
InChI InChI=1S/C30H35NO4S/c1-4-5-6-7-8-9-19-36-27-16-14-24-28-22(27)11-10-12-23(28)29(32)31(30(24)33)18-17-21-13-15-25(34-2)26(20-21)35-3/h10-16,20H,4-9,17-19H2,1-3H3
InChIKey YWPDHBAXGOTRHG-UHFFFAOYSA-N
Mol Weight 505.7 g/mol
Molecular Formula C30H35NO4S
Exact Mass 505.22868 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KKofcNMtCDM
Name N-(3,4-Dimethoxyphenethyl)-4-(octylthio)naphthalimide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 505.228679781 u
Formula C30H35NO4S
InChI InChI=1S/C30H35NO4S/c1-4-5-6-7-8-9-19-36-27-16-14-24-28-22(27)11-10-12-23(28)29(32)31(30(24)33)18-17-21-13-15-25(34-2)26(20-21)35-3/h10-16,20H,4-9,17-19H2,1-3H3
InChIKey YWPDHBAXGOTRHG-UHFFFAOYSA-N
Molecular Weight 505.673 g/mol
SMILES C=12C=CC(=C3C=CC=C(C(N(C2=O)CCC=2C=C(C(=CC2)OC)OC)=O)C13)SCCCCCCCC