SpectraBase Spectrum ID |
JESnHoEajT6 |
Name |
Maltol |
CAS Registry Number |
118-71-8 |
Classification |
Fragrance intensifier |
Comments |
Spectrum verified by crosschecking against external libraries (two reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. 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 |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
126.111 g/mol |
Nominal Mass |
126 u |
Quality |
1000 |
Retention Index |
904 |
SMILES |
OC1=C(OC=CC1=O)C |
SPLASH |
splash10-004i-9600000000-a52ee1cbea97e1062060 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
Veltol
3-Hydroxy-2-methyl-pyran-4-one |
Technique |
GC/MS |
Wiley ID |
DD2024_024757 |