| SpectraBase Spectrum ID |
1nOTXysSPyT |
| Name |
Heptalactone |
| Source of Sample |
SAFC Cat.no. W253901 |
| CAS Registry Number |
105-21-5 |
| 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 |
128.083729624 u |
| Formula |
C7H12O2 |
| InChI |
InChI=1S/C7H12O2/c1-2-3-6-4-5-7(8)9-6/h6H,2-5H2,1H3 |
| InChIKey |
VLSVVMPLPMNWBH-UHFFFAOYSA-N |
| Molecular Weight |
128.171 g/mol |
| Number of Peaks |
50 |
| RI1 |
1155 |
| RI2 |
832 |
| RI3 |
1185 |
| RI4 |
1144 |
| SMILES |
C1(CCC(O1)CCC)=O |
| SPLASH |
splash10-000i-9000000000-3e403514856db9efa649 |
| 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(3H)-Furanone, dihydro-5-propyl- |
| Wiley ID |
LM_FFNSC3_550 |
