SpectraBase Spectrum ID |
J2Tqhyhz1eX |
Name |
Hexalactone |
Source of Sample |
SAFC Cat.no. W316709 |
CAS Registry Number |
823-22-3 |
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 |
114.068079560 u |
Formula |
C6H10O2 |
InChI |
InChI=1S/C6H10O2/c1-5-3-2-4-6(7)8-5/h5H,2-4H2,1H3 |
InChIKey |
RZTOWFMDBDPERY-UHFFFAOYSA-N |
Molecular Weight |
114.144 g/mol |
Number of Peaks |
42 |
RI1 |
1196 |
RI2 |
874 |
RI3 |
1158 |
RI4 |
1115 |
SMILES |
C1CCC(OC1=O)C |
SPLASH |
splash10-0006-9000000000-e175ba8719567d67a9bd |
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 |
2H-Pyran-2-one, tetrahydro-6-methyl- |
Wiley ID |
LM_FFNSC3_210 |