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2-Thioxo-3-methyl-cis-perhydro-1,3-benzoxazine
SpectraBase Compound ID 8YCsIze6uXh
InChI InChI=1S/C9H15NOS/c1-10-6-7-4-2-3-5-8(7)11-9(10)12/h7-8H,2-6H2,1H3/t7-,8-/m0/s1
InChIKey SYNSLKSOSFIBOF-YUMQZZPRSA-N
Mol Weight 185.28 g/mol
Molecular Formula C9H15NOS
Exact Mass 185.087435 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CAKZQJPnNd5
Name 2-Thioxo-3-methyl-cis-perhydro-1,3-benzoxazine
Alternate Name(s) 3-Methyloctahydro-2H-1,3-benzoxazine-2-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H15NOS
InChI InChI=1S/C9H15NOS/c1-10-6-7-4-2-3-5-8(7)11-9(10)12/h7-8H,2-6H2,1H3/t7-,8-/m0/s1
InChIKey SYNSLKSOSFIBOF-YUMQZZPRSA-N
Molecular Weight 185.285 g/mol
SMILES C1(N(C[C@]2([C@@](O1)(CCCC2)[H])[H])C)=S
SPLASH splash10-000f-9400000000-ff4495e3efef87fb2f4e
Source of Spectrum SB-44-166-4
Wiley ID 744628