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N-Benzyl-N-(3-formyl-4-hydroxy-5,6,7,8-tetrahydronaphthalen-2-yl)-4-methylbenzenesulfonamide
SpectraBase Compound ID K7kJYO6oHbr
InChI InChI=1S/C25H25NO4S/c1-18-11-13-21(14-12-18)31(29,30)26(16-19-7-3-2-4-8-19)24-15-20-9-5-6-10-22(20)25(28)23(24)17-27/h2-4,7-8,11-15,17,28H,5-6,9-10,16H2,1H3
InChIKey JIYVINDPCRTMSF-UHFFFAOYSA-N
Mol Weight 435.54 g/mol
Molecular Formula C25H25NO4S
Exact Mass 435.150429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cfah5irHhZ0
Name N-Benzyl-N-(3-formyl-4-hydroxy-5,6,7,8-tetrahydronaphthalen-2-yl)-4-methylbenzenesulfonamide
Appearance Amorphous solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 435.150429459 u
Formula C25H25NO4S
InChI InChI=1S/C25H25NO4S/c1-18-11-13-21(14-12-18)31(29,30)26(16-19-7-3-2-4-8-19)24-15-20-9-5-6-10-22(20)25(28)23(24)17-27/h2-4,7-8,11-15,17,28H,5-6,9-10,16H2,1H3
InChIKey JIYVINDPCRTMSF-UHFFFAOYSA-N
Instrument Name Hewlett-Packard 5995
Ionization Type EI
Literature Reference DOI 10.1002/chem.201503171
Molecular Weight 435.538 g/mol
Quality 44
Reported Formula C25H25NO4S
SMILES OC=1C2=C(C=C(N(S(C3=CC=C(C=C3)C)(=O)=O)CC3=CC=CC=C3)C1C=O)CCCC2
SPLASH splash10-001i-3090000000-22dcd64c045e1f619fe7
Source of Spectrum QE-21-SM10-14o (DOI: 10.1002/chem.201503171)
Wiley ID 1907449