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(1R,exo,exo)-3-[N-(3,5-Dimethylphenyl)benzenesulfonamido]isoborneol
SpectraBase Compound ID AVdVo8yYH4D
InChI InChI=1S/C24H31NO3S/c1-16-13-17(2)15-18(14-16)25(29(27,28)19-9-7-6-8-10-19)21-20-11-12-24(5,22(21)26)23(20,3)4/h6-10,13-15,20-22,26H,11-12H2,1-5H3/t20-,21-,22-,24+/m1/s1
InChIKey XOYOZKHVKVMVIE-AZKZNFPZSA-N
Mol Weight 413.58 g/mol
Molecular Formula C24H31NO3S
Exact Mass 413.202465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JBtTv1Qpo7B
Name N-(3,5-Dimethylphenyl)-N-[(1S,2R,3S,4R)-3-hydroxy-4,7,7-trimethylbicyclo[2.2.1]hept-2-yl]benzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H31NO3S
InChI InChI=1S/C24H31NO3S/c1-16-13-17(2)15-18(14-16)25(29(27,28)19-9-7-6-8-10-19)21-20-11-12-24(5,22(21)26)23(20,3)4/h6-10,13-15,20-22,26H,11-12H2,1-5H3/t20-,21-,22-,24+/m1/s1
InChIKey XOYOZKHVKVMVIE-AZKZNFPZSA-N
Molecular Weight 413.576 g/mol
SMILES O[C@]1([C@@]2(CC[C@]([C@]1(N(S(=O)(=O)c1ccccc1)c1cc(C)cc(c1)C)[H])(C2(C)C)[H])C)[H]
SPLASH splash10-0229-0490600000-520499a22a3dca71139c
Source of Spectrum U1-2008-5326-a
Synonyms N-(3,5-dimethylphenyl)-N-[(1S,2R,3S,4R)-3-hydroxy-4,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]benzenesulfonamide N-(3,5-dimethylphenyl)-N-[(1S,2R,3S,4R)-4,7,7-trimethyl-3-oxidanyl-2-bicyclo[2.2.1]heptanyl]benzenesulfonamide
Wiley ID 1710591