| SpectraBase Spectrum ID |
C9T36qa8Bwt |
| Name |
2-isobutoxy-5-(4-methyl-2-propanoyl-thiazol-5-yl)benzonitrile |
| Appearance |
Slightly yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H20N2O2S |
| GC Column |
Agilent 190915-433UI (30 m x 250 microm, film thickness 0.25 micrometer) |
| GC Oven Program |
Oven temp 320oC |
| InChI |
InChI=1S/C18H20N2O2S/c1-5-15(21)18-20-12(4)17(23-18)13-6-7-16(14(8-13)9-19)22-10-11(2)3/h6-8,11H,5,10H2,1-4H3 |
| InChIKey |
JBXBBOACPACSJW-UHFFFAOYSA-N |
| Instrument Name |
Agilent 8890-5977B |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.202202212 |
| Molecular Weight |
328.430 g/mol |
| SMILES |
C1(=C(C=C(C=C1)C=1SC(=NC1C)C(=O)CC)C#N)OCC(C)C |
| SPLASH |
splash10-0006-0091000000-344414eaf273bb8d2341 |
| Source of Spectrum |
QE-28-SM175-3Qa(SM175) (DOI: 10.1002/chem.202202212) |
| Thin-Layer Chromatography |
0.40 (nHex/EA , 9:1) |
| Wiley ID |
1902388 |
