| SpectraBase Spectrum ID |
Lr7y4h5ZZWA |
| Name |
3-Benzoylbut-3-enoic acid |
| Appearance |
Pale yellow oil |
| Carrier Gas |
Helium (80 ml/min) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H10O3 |
| GC Column |
SUPELCO SIMPLICITYTM (30 m x 0.25 mm) |
| GC Oven Program |
Oven temp 230oC |
| InChI |
InChI=1S/C11H10O3/c1-8(7-10(12)13)11(14)9-5-3-2-4-6-9/h2-6H,1,7H2,(H,12,13) |
| InChIKey |
KJIQTYSDCUGQPZ-UHFFFAOYSA-N |
| Instrument Name |
SHIMADZU GCMS-QP 5000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3998/ark.5550190.0002.608 |
| Molecular Weight |
190.198 g/mol |
| Quality |
188 |
| SMILES |
OC(CC(C(C1=CC=CC=C1)=O)=C)=O |
| SPLASH |
splash10-0a4i-6900000000-1125f9af8e10862ad18a |
| Source of Spectrum |
ARK-2001-90-2d (DOI: 10.3998/ark.5550190.0002.608) |
| Wiley ID |
1908774 |
