| SpectraBase Spectrum ID |
BSnC0jBXEvL |
| Name |
Pyromucic acid |
| Source of Sample |
SAFC Cat.no. W501506 |
| CAS Registry Number |
88-14-2 |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
112.016043986 u |
| Formula |
C5H4O3 |
| InChI |
InChI=1S/C5H4O3/c6-5(7)4-2-1-3-8-4/h1-3H,(H,6,7) |
| InChIKey |
SMNDYUVBFMFKNZ-UHFFFAOYSA-N |
| Molecular Weight |
112.084 g/mol |
| Number of Peaks |
17 |
| RI1 |
1087 |
| RI2 |
761 |
| RI5 |
1059 |
| SMILES |
OC(c1ccco1)=O |
| SPLASH |
splash10-03dj-9700000000-dfa73b065ed0e3b6a673 |
| Sample Comments |
RI1: measured on SLB-5ms (Hydro)
RI2: measured on SLB-5ms (FAMEs)
RI3: measured on Supelcowax-10 (FAMEs)
RI4: measured on Supelcowax-10 (FAEEs)
RI5: measured on Equity-1 (Hydro) |
| Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
| Synonyms |
2-Furancarboxylic acid |
| Wiley ID |
LM_FFNSC3_894 |
