| SpectraBase Spectrum ID |
6W0j18bEGlS |
| Name |
Pyran-4-one <4H-, 2-methyl-, 3-(1-oxopropoxy)-> |
| CAS Registry Number |
68555-63-5 |
| 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 |
182.057908798 u |
| Formula |
C9H10O4 |
| InChI |
InChI=1S/C9H10O4/c1-3-8(11)13-9-6(2)12-5-4-7(9)10/h4-5H,3H2,1-2H3 |
| InChIKey |
NBKYPRRBTKRGLE-UHFFFAOYSA-N |
| Molecular Weight |
182.175 g/mol |
| Number of Peaks |
50 |
| RI1 |
1452 |
| RI2 |
1130 |
| SMILES |
C1=CC(C(=C(O1)C)OC(CC)=O)=O |
| SPLASH |
splash10-004i-8900000000-141a4368ee73ac632a41 |
| 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, 2-methyl-3-(1-oxopropoxy)- |
| Wiley ID |
LM_FFNSC3_1430 |
