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8,8-Dimethyl-6-(4-methylphenylsulfonyloxy)-1-azatricyclo[3.2.1.0(2,7)]octane
SpectraBase Compound ID Bsmy1nq1rC5
InChI InChI=1S/C16H21NO3S/c1-10-4-6-11(7-5-10)21(18,19)20-15-12-8-9-13-14(15)17(13)16(12,2)3/h4-7,12-15H,8-9H2,1-3H3/t12-,13+,14?,15?,17?/m1/s1
InChIKey LNTQCYNKFABFKI-UHFFFAOYSA-N
Mol Weight 307.41 g/mol
Molecular Formula C16H21NO3S
Exact Mass 307.124215 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2gFDB1Jg1xM
Name 8,8-Dimethyl-6-(4-methylphenylsulfonyloxy)-1-azatricyclo[3.2.1.0(2,7)]octane
CAS Registry Number 105815-52-9
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21NO3S
InChI InChI=1S/C16H21NO3S/c1-10-4-6-11(7-5-10)21(18,19)20-15-12-8-9-13-14(15)17(13)16(12,2)3/h4-7,12-15H,8-9H2,1-3H3/t12-,13+,14?,15?,17?/m1/s1
InChIKey LNTQCYNKFABFKI-UHFFFAOYSA-N
Molecular Weight 307.408 g/mol
SMILES C12N3C([C@@](C2OS(c2ccc(cc2)C)(=O)=O)(CC[C@@]13[H])[H])(C)C
SPLASH splash10-000i-5900000000-227b1e32196caad88dd9
Source of Spectrum K-120-1777-14
Synonyms 8,8-Dimethyl-1-azatricyclo[3.2.1.0(2,7)]oct-6-yl 4-methylbenzenesulfonate
Wiley ID 1308908