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4-Methyl-N-(((1S*,2R*,4R*,5R*)-4-methyl-3-oxobicyclo[3.2.1]oct-6-en-2-yl)methyl)benzenesulfonamide
SpectraBase Compound ID ABzhNxzXbAq
InChI InChI=1S/C17H21NO3S/c1-11-3-7-15(8-4-11)22(20,21)18-10-16-14-6-5-13(9-14)12(2)17(16)19/h3-8,12-14,16,18H,9-10H2,1-2H3/t12-,13+,14-,16+/m1/s1
InChIKey MZJGYGXCHZHVRB-CTASWTNQSA-N
Mol Weight 319.42 g/mol
Molecular Formula C17H21NO3S
Exact Mass 319.124215 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A8k0Nidzsih
Name 4-Methyl-N-(((1S*,2R*,4R*,5R*)-4-methyl-3-oxobicyclo[3.2.1]oct-6-en-2-yl)methyl)benzenesulfonamide
Alternate Name(s) 4-Methyl-N-(((1S,2R,4R,5R)-4-methyl-3-oxobicyclo[3.2.1]oct-6-en-2-yl)methyl)benzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21NO3S
InChI InChI=1S/C17H21NO3S/c1-11-3-7-15(8-4-11)22(20,21)18-10-16-14-6-5-13(9-14)12(2)17(16)19/h3-8,12-14,16,18H,9-10H2,1-2H3/t12-,13+,14-,16+/m1/s1
InChIKey MZJGYGXCHZHVRB-CTASWTNQSA-N
Literature Reference DOI 10.1039/c3cc48266a
Molecular Weight 319.419 g/mol
SMILES N(C[C@@]1(C([C@](C)([C@@]2(C[C@]1(C=C2)[H])[H])[H])=O)[H])S(c1ccc(cc1)C)(=O)=O
SPLASH splash10-0006-9800000000-c46907ee059706c1e2dd
Source of Spectrum KD-50-1738/SMS47-beta_4lb
Wiley ID 1754320