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9-Methyl-3-thia-9-azabicyclo[3.3.1]nonan-7-one
SpectraBase Compound ID 32KoZT2ykdz
InChI InChI=1S/C8H13NOS/c1-9-6-2-8(10)3-7(9)5-11-4-6/h6-7H,2-5H2,1H3/t6-,7-/m0/s1
InChIKey NYRXKNVUTSUPFL-BQBZGAKWSA-N
Mol Weight 171.26 g/mol
Molecular Formula C8H13NOS
Exact Mass 171.071785 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KJxv70817Wq
Name 9-Methyl-3-thia-9-azabicyclo[3.3.1]nonan-7-one
CAS Registry Number 99709-31-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H13NOS
InChI InChI=1S/C8H13NOS/c1-9-6-2-8(10)3-7(9)5-11-4-6/h6-7H,2-5H2,1H3/t6-,7-/m0/s1
InChIKey NYRXKNVUTSUPFL-BQBZGAKWSA-N
Molecular Weight 171.258 g/mol
SMILES C1[C@@]2(CC(C[C@](N2C)(CS1)[H])=O)[H]
SPLASH splash10-03di-8900000000-579e896e310230dae757
Synonyms 3-Thia-9-azabicyclo[3.3.1]nonan-7-one, 9-methyl-
Wiley ID 1488611