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(2S)-4-Methyl-2-(2,5-dimethyl-1-oxa-spiro[2.5]oct-2-yl)thiazole
SpectraBase Compound ID 4i5rwWkZqNM
InChI InChI=1S/C13H19NOS/c1-9-5-4-6-13(7-9)12(3,15-13)11-14-10(2)8-16-11/h8-9H,4-7H2,1-3H3/t9?,12-,13?/m1/s1
InChIKey OHXSUOUIWCLMKP-BKDHPRRPSA-N
Mol Weight 237.36 g/mol
Molecular Formula C13H19NOS
Exact Mass 237.118735 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EjoQ2kl6Xyh
Name (2S)-[(2R)-2,5-dimethyl-1-oxaspiro[2.5]octan-2-yl]-4-methyl-thiazole
Appearance Yellow oil
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Formula C13H19NOS
InChI InChI=1S/C13H19NOS/c1-9-5-4-6-13(7-9)12(3,15-13)11-14-10(2)8-16-11/h8-9H,4-7H2,1-3H3/t9?,12-,13?/m1/s1
InChIKey OHXSUOUIWCLMKP-BKDHPRRPSA-N
Instrument Name Shimadzu GCMS-QP5050A
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0005.e06
Molecular Weight 237.361 g/mol
SMILES c1(scc(n1)C)[C@]1(OC11CC(CCC1)C)C
SPLASH splash10-0006-0930000000-d2fe93d1582ad7dc95bb
Sample Comments dr = 43:7
Source of Spectrum ARK-2004-70-7d
Wiley ID 1875913