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(anti)-8-t-butoxy-2-(4'-methylphenylsulphonyl)-2-azabicyclo[3.2.1]octa-3,6-diene
SpectraBase Compound ID DqccrraSvt2
InChI InChI=1S/C18H23NO3S/c1-13-5-8-15(9-6-13)23(20,21)19-12-11-14-7-10-16(19)17(14)22-18(2,3)4/h5-12,14,16-17H,1-4H3
InChIKey RGBHPWZYLRLWCK-UHFFFAOYSA-N
Mol Weight 333.45 g/mol
Molecular Formula C18H23NO3S
Exact Mass 333.139865 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8cBdfUHaESJ
Name (anti)-8-t-butoxy-2-(4'-methylphenylsulphonyl)-2-azabicyclo[3.2.1]octa-3,6-diene
CAS Registry Number 136708-47-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H23NO3S
InChI InChI=1S/C18H23NO3S/c1-13-5-8-15(9-6-13)23(20,21)19-12-11-14-7-10-16(19)17(14)22-18(2,3)4/h5-12,14,16-17H,1-4H3
InChIKey RGBHPWZYLRLWCK-UHFFFAOYSA-N
Molecular Weight 333.446 g/mol
SMILES C12N(S(c3ccc(cc3)C)(=O)=O)C=CC(C1OC(C)(C)C)C=C2
SPLASH splash10-0a4i-9010000000-621efcc451583640a3fe
Source of Spectrum K-124-2890-2
Synonyms 8-tert-Butoxy-2-[(4-methylphenyl)sulfonyl]-2-azabicyclo[3.2.1]octa-3,6-diene tert-Butyl 2-[(4-methylphenyl)sulfonyl]-2-azabicyclo[3.2.1]octa-3,6-dien-8-yl ether
Wiley ID 1330206