| SpectraBase Spectrum ID |
BfJS67SBdHq |
| Name |
methyl 3-(3-oxobutyl)thiophene-2-carboxylate |
| Appearance |
Colorless liquid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
212.050715417 u |
| Formula |
C10H12O3S |
| GC Column |
HP-5 |
| GC Oven Program |
Oven temp 300oC |
| InChI |
InChI=1S/C10H12O3S/c1-7(11)3-4-8-5-6-14-9(8)10(12)13-2/h5-6H,3-4H2,1-2H3 |
| InChIKey |
YFWUEJZSPXRERS-UHFFFAOYSA-N |
| Instrument Name |
Agilent GC-MS 5977B MSD |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201800757 |
| Molecular Weight |
212.263 g/mol |
| Quality |
95 |
| Reported Formula |
C10H12O3S |
| SMILES |
COC(=O)C=1SC=CC1CCC(C)=O |
| SPLASH |
splash10-000i-2900000000-958ffd12ac37bd7dbae0 |
| Source of Spectrum |
QE-24-SM18-3xa (DOI: 10.1002/chem.201800757) |
| Wiley ID |
1900165 |
