| SpectraBase Spectrum ID |
95ZT1NNsCdT |
| Name |
Methyl 3-(4-hydroxyhex-1-yn-1-yl)thiophene-2-carboxylate |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H14O3S |
| InChI |
InChI=1S/C12H14O3S/c1-3-10(13)6-4-5-9-7-8-16-11(9)12(14)15-2/h7-8,10,13H,3,6H2,1-2H3 |
| InChIKey |
XMDIJFIJEPBVPU-UHFFFAOYSA-N |
| Instrument Name |
GCMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/adsc.202200958 |
| Molecular Weight |
238.301 g/mol |
| Reported Formula |
C12H14O3S |
| SMILES |
OC(CC#Cc1c(C(OC)=O)scc1)CC |
| SPLASH |
splash10-00li-0900000000-ef5737673cc7f0ebe5ce |
| Source of Spectrum |
ASC-364-SM5-5-2 |
| Wiley ID |
1877465 |
