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(2S)-4-Methyl-2-(4-methyl-1-oxa-spiro[2.5]oct-2-yl)thiazole
SpectraBase Compound ID LGFrWbdj2Lr
InChI InChI=1S/C12H17NOS/c1-8-5-3-4-6-12(8)10(14-12)11-13-9(2)7-15-11/h7-8,10H,3-6H2,1-2H3/t8?,10-,12?/m1/s1
InChIKey BDVZZGIGUMXTCM-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 EfflyToFWe1
Name (2S)-4-Methyl-2-(4-methyl-1-oxa-spiro[2.5]oct-2-yl)thiazole
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17NOS
InChI InChI=1S/C12H17NOS/c1-8-5-3-4-6-12(8)10(14-12)11-13-9(2)7-15-11/h7-8,10H,3-6H2,1-2H3/t8?,10-,12?/m1/s1
InChIKey BDVZZGIGUMXTCM-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
Optical Rotation [a]D22 = +10.3 (c = 0.03, CHCl3)
SMILES Cc1nc(sc1)[C@]1(OC11C(CCCC1)C)[H]
SPLASH splash10-0h00-0910000000-0bba71b0f7e58369611e
Source of Spectrum ARK-2004-69-6a
Wiley ID 1875908