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(E)-2-(Thiazol-2-yl)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)but-3-en-2-ol
SpectraBase Compound ID Lj9r2PyVIoF
InChI InChI=1S/C16H23NOS/c1-12-6-5-8-15(2,3)13(12)7-9-16(4,18)14-17-10-11-19-14/h6-7,9-11,13,18H,5,8H2,1-4H3/b9-7+
InChIKey IXMMGEVMDUBEGB-VQHVLOKHSA-N
Mol Weight 277.43 g/mol
Molecular Formula C16H23NOS
Exact Mass 277.150036 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ili3r1xOx6N
Name (E)-2-(Thiazol-2-yl)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)but-3-en-2-ol
Appearance Colorless oil
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Formula C16H23NOS
InChI InChI=1S/C16H23NOS/c1-12-6-5-8-15(2,3)13(12)7-9-16(4,18)14-17-10-11-19-14/h6-7,9-11,13,18H,5,8H2,1-4H3/b9-7+
InChIKey IXMMGEVMDUBEGB-VQHVLOKHSA-N
Instrument Name Finnigan MAT95Q or Finnigan MAT90
Ionization Type EI
Literature Reference DOI 10.1002/anie.202103031
Molecular Weight 277.426 g/mol
Reported Formula C16H23NSO
SMILES OC(\C=C\C1C(=CCCC1(C)C)C)(c1sccn1)C
SPLASH splash10-0f79-2910000000-acd0945b14d67663ef44
Sample Comments dr = 1:1
Source of Spectrum ACI-60-SM45-9do
Wiley ID 1882553