| SpectraBase Spectrum ID |
2nJ8NIbxh1U |
| Name |
Pantolactone |
| CAS Registry Number |
599-04-2 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (five 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 |
130.062994179 u |
| Formula |
C6H10O3 |
| InChI |
InChI=1S/C6H10O3/c1-6(2)3-9-5(8)4(6)7/h4,7H,3H2,1-2H3/t4-/m0/s1 |
| InChIKey |
SERHXTVXHNVDKA-BYPYZUCNSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
130.143 g/mol |
| Nominal Mass |
130 u |
| Quality |
972 |
| Retention Index |
928 |
| SMILES |
O[C@@]1(C(COC1=O)(C)C)[H] |
| SPLASH |
splash10-00dl-9000000000-2d308f5a1a5c9e37f78b |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
DL-Pantolacton
Pantoyllactone
3-hydroxy-4,4-dimethyloxolan-2-one |
| Technique |
GC/MS |
| Wiley ID |
DD2024_032675 |
