| SpectraBase Spectrum ID |
2pIkm5opIVi |
| Name |
Dimethyl 2-(6-phenylhex-2-yn-1-yl)malonate |
| Appearance |
Colorless liquid |
| Carrier Gas |
Helium |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H20O4 |
| GC Oven Program |
Oven temp 280oC |
| InChI |
InChI=1S/C17H20O4/c1-20-16(18)15(17(19)21-2)13-9-4-3-6-10-14-11-7-5-8-12-14/h5,7-8,11-12,15H,3,6,10,13H2,1-2H3 |
| InChIKey |
UNAAJMBGCGLIDD-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu GCMS-QP2010 |
| Ionization Type |
EI Positive ion |
| Literature Reference DOI |
10.1002/anie.201706781 |
| Quality |
291 |
| Reported Formula |
C17H20O4 |
| SMILES |
C(C#CCC(C(=O)OC)C(OC)=O)CCC1=CC=CC=C1 |
| SPLASH |
splash10-1003-3900000000-38f309b592d24d507246 |
| Source of Spectrum |
ACI-56-SM33-3q (DOI: 10.1002/anie.201706781) |
| Wiley ID |
1896366 |
