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2-Thioxo-cis-perhydro-1,3-benzoxazine
SpectraBase Compound ID 9YPlUeI8IW1
InChI InChI=1S/C8H13NOS/c11-8-9-5-6-3-1-2-4-7(6)10-8/h6-7H,1-5H2,(H,9,11)/t6-,7-/m0/s1
InChIKey XIQBQRNKFGUKAI-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 8nEYiqyxLVG
Name 2-Thioxo-cis-perhydro-1,3-benzoxazine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H13NOS
InChI InChI=1S/C8H13NOS/c11-8-9-5-6-3-1-2-4-7(6)10-8/h6-7H,1-5H2,(H,9,11)/t6-,7-/m0/s1
InChIKey XIQBQRNKFGUKAI-BQBZGAKWSA-N
Molecular Weight 171.258 g/mol
SMILES N1C[C@@]2(CCCC[C@@]2(OC1=S)[H])[H]
SPLASH splash10-00u6-9100000000-562ca4f6ea367c9ff127
Source of Spectrum SB-44-166-2
Synonyms Octahydro-2H-1,3-benzoxazine-2-thione
Wiley ID 744630