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(2R,6R,9S)-5-Tosyl-5-aza-tetracyclo[8.2.1.0(2,6).0(2,9)]tridec-11-en-3-one
SpectraBase Compound ID 3LPqPR7dYcS
InChI InChI=1S/C19H21NO3S/c1-12-2-6-15(7-3-12)24(22,23)20-11-18(21)19-14-5-4-13(10-14)16(19)8-9-17(19)20/h2-7,13-14,16-17H,8-11H2,1H3/t13-,14+,16-,17+,19-/m0/s1
InChIKey AFUADQWLJLTQSY-JLFGJHNZSA-N
Mol Weight 343.44 g/mol
Molecular Formula C19H21NO3S
Exact Mass 343.124215 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9TxnuxeqS8R
Name (2R,6R,9S)-5-Tosyl-5-aza-tetracyclo[8.2.1.0(2,6).0(2,9)]tridec-11-en-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21NO3S
InChI InChI=1S/C19H21NO3S/c1-12-2-6-15(7-3-12)24(22,23)20-11-18(21)19-14-5-4-13(10-14)16(19)8-9-17(19)20/h2-7,13-14,16-17H,8-11H2,1H3/t13-,14+,16-,17+,19-/m0/s1
InChIKey AFUADQWLJLTQSY-JLFGJHNZSA-N
Molecular Weight 343.441 g/mol
SMILES c1(S(N2[C@]3([C@@]4([C@@]5(C=C[C@]([C@@]4(CC3)[H])(C5)[H])[H])C(C2)=O)[H])(=O)=O)ccc(cc1)C
SPLASH splash10-00l6-9600000000-7d562376680194b3ff22
Source of Spectrum F5-6-3133-36
Synonyms 5-Tosyl-5-azatetracyclo[8.2.1.0(2,6).0(2,9)]tridec-11-en-3-one (3aR,5aS,6R,9S,9aS)-3-tosyl-2,3,3a,4,5,5a,6,9-octahydro-1H-6,9-methanoindeno[1,7a-b]pyrrol-1-one
Wiley ID 1733556