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(2S)-4-Methyl-2-(5-methyl-1-oxa-spiro[2.5]oct-2-yl)thiazole
SpectraBase Compound ID 5SCb81he4jT
InChI InChI=1S/C12H17NOS/c1-8-4-3-5-12(6-8)10(14-12)11-13-9(2)7-15-11/h7-8,10H,3-6H2,1-2H3/t8?,10-,12?/m1/s1
InChIKey JNVIZPGVQBYWDN-KRBLXSNTSA-N
Mol Weight 223.33 g/mol
Molecular Formula C12H17NOS
Exact Mass 223.103085 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GM6ZjcFsb0o
Name (2S)-4-Methyl-2-(5-methyl-1-oxa-spiro[2.5]oct-2-yl)thiazole
Appearance Yellow oil
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Formula C12H17NOS
InChI InChI=1S/C12H17NOS/c1-8-4-3-5-12(6-8)10(14-12)11-13-9(2)7-15-11/h7-8,10H,3-6H2,1-2H3/t8?,10-,12?/m1/s1
InChIKey JNVIZPGVQBYWDN-KRBLXSNTSA-N
Instrument Name Shimadzu GCMS-QP5050A
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0005.e06
Molecular Weight 223.334 g/mol
SMILES c1(nc(sc1)[C@@]1(C2(O1)CCCC(C2)C)[H])C
SPLASH splash10-06tf-0930000000-62282a62b4772524ac0a
Sample Comments Diastereoisomer mixture (25:25)
Source of Spectrum ARK-2004-69-5d
Wiley ID 1875907