SpectraBase Spectrum ID |
LhFYqKQBQtW |
Name |
Maltol |
Source of Sample |
SAFC Cat.no. W265608 |
CAS Registry Number |
118-71-8 |
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 |
126.031694050 u |
Formula |
C6H6O3 |
InChI |
InChI=1S/C6H6O3/c1-4-6(8)5(7)2-3-9-4/h2-3,8H,1H3 |
InChIKey |
XPCTZQVDEJYUGT-UHFFFAOYSA-N |
Molecular Weight |
126.111 g/mol |
Number of Peaks |
50 |
RI1 |
1108 |
RI2 |
784 |
RI3 |
1361 |
RI4 |
1323 |
RI5 |
1081 |
SMILES |
OC=1C(C=COC1C)=O |
SPLASH |
splash10-004i-9400000000-46be1b25cc71a2f75e6e |
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 |
4H-Pyran-4-one, 3-hydroxy-2-methyl- |
Wiley ID |
LM_FFNSC3_1628 |