| SpectraBase Spectrum ID |
KfDkm9WlLn1 |
| Name |
Malate |
| Source of Sample |
SAFC Cat.no. W237418 |
| CAS Registry Number |
7554-12-3 |
| 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 |
190.084123546 u |
| Formula |
C8H14O5 |
| InChI |
InChI=1S/C8H14O5/c1-3-12-7(10)5-6(9)8(11)13-4-2/h6,9H,3-5H2,1-2H3 |
| InChIKey |
VKNUORWMCINMRB-UHFFFAOYSA-N |
| Molecular Weight |
190.195 g/mol |
| Number of Peaks |
50 |
| RI1 |
1268 |
| RI2 |
945 |
| RI3 |
1414 |
| RI4 |
1371 |
| RI5 |
1064 |
| SMILES |
OC(CC(OCC)=O)C(OCC)=O |
| SPLASH |
splash10-01bc-9400000000-9a5987db9c4fbe7055c5 |
| 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 |
Butanedioic acid, hydroxy-, diethyl ester |
| Wiley ID |
LM_FFNSC3_71 |
