| SpectraBase Spectrum ID |
A2u00U79aPF |
| Name |
Methyl 3-benzoylbut-3-enoate |
| Appearance |
Oil |
| Carrier Gas |
Helium (80 ml/min) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
204.078644243 u |
| Formula |
C12H12O3 |
| GC Column |
SUPELCO SIMPLICITYTM (30 m x 0.25 mm) |
| GC Oven Program |
Oven temp 230oC |
| InChI |
InChI=1S/C12H12O3/c1-9(8-11(13)15-2)12(14)10-6-4-3-5-7-10/h3-7H,1,8H2,2H3 |
| InChIKey |
MMAJXVJTOBNDCQ-UHFFFAOYSA-N |
| Instrument Name |
SHIMADZU GCMS-QP 5000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3998/ark.5550190.0002.608 |
| Molecular Weight |
204.225 g/mol |
| Quality |
265 |
| SMILES |
COC(CC(=C)C(C1=CC=CC=C1)=O)=O |
| SPLASH |
splash10-0a6r-4900000000-513d58de7a7888372fb8 |
| Source of Spectrum |
ARK-2001-89-2c (DOI: 10.3998/ark.5550190.0002.608) |
| Wiley ID |
1908773 |
