| SpectraBase Spectrum ID |
Bimedg1G4m5 |
| Name |
Hex-(2E)-enoic acid |
| Source of Sample |
SAFC Cat.no. W316903 |
| CAS Registry Number |
13419-69-7 |
| 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 |
114.068079560 u |
| Formula |
C6H10O2 |
| InChI |
InChI=1S/C6H10O2/c1-2-3-4-5-6(7)8/h4-5H,2-3H2,1H3,(H,7,8)/b5-4+ |
| InChIKey |
NIONDZDPPYHYKY-SNAWJCMRSA-N |
| Molecular Weight |
114.144 g/mol |
| Number of Peaks |
50 |
| RI1 |
1030 |
| RI2 |
701 |
| RI3 |
1628 |
| RI4 |
1589 |
| SMILES |
OC(\C=C\CCC)=O |
| SPLASH |
splash10-006x-9000000000-2aa4f8671d46363bd757 |
| 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-Hexenoic acid, (2E)- |
| Wiley ID |
LM_FFNSC3_1626 |
