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4-Phenyl-2-thioxo-cis-5,6-trimethyleneperhydro-1,3-oxazine
SpectraBase Compound ID B4690EbMUYJ
InChI InChI=1S/C13H15NOS/c16-13-14-12(9-5-2-1-3-6-9)10-7-4-8-11(10)15-13/h1-3,5-6,10-12H,4,7-8H2,(H,14,16)
InChIKey QTUPPWHUAOAFLB-UHFFFAOYSA-N
Mol Weight 233.33 g/mol
Molecular Formula C13H15NOS
Exact Mass 233.087435 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 804yArfycoK
Name 4-Phenyl-2-thioxo-cis-5,6-trimethyleneperhydro-1,3-oxazine
CAS Registry Number 132287-28-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NOS
InChI InChI=1S/C13H15NOS/c16-13-14-12(9-5-2-1-3-6-9)10-7-4-8-11(10)15-13/h1-3,5-6,10-12H,4,7-8H2,(H,14,16)
InChIKey QTUPPWHUAOAFLB-UHFFFAOYSA-N
Molecular Weight 233.329 g/mol
SMILES N1C(C2C(OC1=S)CCC2)c1ccccc1
SPLASH splash10-0a59-3930000000-8ce80ca6a1686ba3f13c
Source of Spectrum G1-0-0-0
Synonyms 4-Phenyl-4,4a,5,6,7,7a-hexahydro-3H-cyclopenta[e][1,3]oxazine-2-thione 4-Phenylhexahydrocyclopenta[e][1,3]oxazine-2(3H)-thione
Wiley ID 1234857