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4-Phenyloctahydro-2H-1,3-benzoxazine-2-thione
SpectraBase Compound ID K921EQNRnQy
InChI InChI=1S/C14H17NOS/c17-14-15-13(10-6-2-1-3-7-10)11-8-4-5-9-12(11)16-14/h1-3,6-7,11-13H,4-5,8-9H2,(H,15,17)
InChIKey GMSXGYJKWBZMDY-UHFFFAOYSA-N
Mol Weight 247.36 g/mol
Molecular Formula C14H17NOS
Exact Mass 247.103085 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5x2TMxD9dJU
Name 4-Phenyloctahydro-2H-1,3-benzoxazine-2-thione
CAS Registry Number 128258-96-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17NOS
InChI InChI=1S/C14H17NOS/c17-14-15-13(10-6-2-1-3-7-10)11-8-4-5-9-12(11)16-14/h1-3,6-7,11-13H,4-5,8-9H2,(H,15,17)
InChIKey GMSXGYJKWBZMDY-UHFFFAOYSA-N
Molecular Weight 247.356 g/mol
SMILES SC1=NC(c2ccccc2)C2CCCCC2O1
SPLASH splash10-052b-3930000000-ec8cb122d50b197e29f8
Source of Spectrum Y-28-254-4
Synonyms 1,3-Benzoxazine, perhydro-4-phenyl-2-thioxo-, cis- 4-Phenyl-3,4,4a,5,6,7,8,8a-octahydrobenzo[e][1,3]oxazine-2-thione 4-Phenyl-5,6-tetramethylenetetrahydro-1,3-oxazine-2-thione
Wiley ID 1250003