| SpectraBase Spectrum ID |
1rUoegmXM39 |
| Name |
4-Ethynylbenzoic acid |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
146.036779431 u |
| Formula |
C9H6O2 |
| InChI |
InChI=1S/C9H6O2/c1-2-7-3-5-8(6-4-7)9(10)11/h1,3-6H,(H,10,11) |
| InChIKey |
SJXHLZCPDZPBPW-UHFFFAOYSA-N |
| Instrument Name |
FINNIGAN MAT 95 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3762/bjoc.18.111 |
| Molecular Weight |
146.145 g/mol |
| Quality |
207 |
| Reported Formula |
C9H6O2 |
| SMILES |
OC(C1=CC=C(C#C)C=C1)=O |
| SPLASH |
splash10-002b-0900000000-cdf6ac73272e707b61da |
| Source of Spectrum |
BJO-18-SM56-4p (DOI: 10.3762/bjoc.18.111) |
| Thin-Layer Chromatography |
0.19 (CH2Cl2/MeOH, 10:1) |
| Wiley ID |
1901221 |
