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2-Thioxo-trans-perhydro-1,3-benzoxazine
SpectraBase Compound ID 2yFJ45wcHsg
InChI InChI=1S/C8H13NOS/c11-8-9-5-6-3-1-2-4-7(6)10-8/h6-7H,1-5H2,(H,9,11)
InChIKey XIQBQRNKFGUKAI-UHFFFAOYSA-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 15kMS9OSR4V
Name 2-Thioxo-trans-perhydro-1,3-benzoxazine
CAS Registry Number 66328-30-1
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)
InChIKey XIQBQRNKFGUKAI-UHFFFAOYSA-N
Molecular Weight 171.258 g/mol
SMILES N1CC2CCCCC2OC1=S
SPLASH splash10-0096-9300000000-cb55ec3c957e0cbc9cba
Source of Spectrum SB-44-166-3
Synonyms Octahydro-2H-1,3-benzoxazine-2-thione 2-Thioxo-cis-perhydro-1,3-benzoxazine 3,4,4a,5,6,7,8,8a-octahydrobenzo[e][1,3]oxazine-2-thione 5,6-Tetramethylenetetrahydro-1,3-oxazine-2-thione
Wiley ID 744629