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N~1~,N~5~-bis(2-phenoxyethyl)-1,5-naphthalenedisulfonamide
SpectraBase Compound ID BmdVPTuc5Qr
InChI InChI=1S/C26H26N2O6S2/c29-35(30,27-17-19-33-21-9-3-1-4-10-21)25-15-7-14-24-23(25)13-8-16-26(24)36(31,32)28-18-20-34-22-11-5-2-6-12-22/h1-16,27-28H,17-20H2
InChIKey WVWAQKMRFFJBFD-UHFFFAOYSA-N
Mol Weight 526.62 g/mol
Molecular Formula C26H26N2O6S2
Exact Mass 526.123229 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LPTM2YlTwzq
Name N~1~,N~5~-bis(2-Phenoxyethyl)-1,5-naphthalenedisulfonamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 526.123228907 u
Formula C26H26N2O6S2
InChI InChI=1S/C26H26N2O6S2/c29-35(30,27-17-19-33-21-9-3-1-4-10-21)25-15-7-14-24-23(25)13-8-16-26(24)36(31,32)28-18-20-34-22-11-5-2-6-12-22/h1-16,27-28H,17-20H2
InChIKey WVWAQKMRFFJBFD-UHFFFAOYSA-N
Molecular Weight 526.622 g/mol
SMILES N(S(C=1C2=C(C(S(=O)(=O)NCCOC3=CC=CC=C3)=CC=C2)C=CC1)(=O)=O)CCOC=1C=CC=CC1