| SpectraBase Spectrum ID |
FRPjMzKUxFn |
| Name |
Pyran-5-one<2,2-dimethyl-7-isobutyl-2H,5H-pyr |
| CAS Registry Number |
174844-18-9 |
| 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 |
234.125594437 u |
| Formula |
C14H18O3 |
| GC Column |
J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness) |
| GC Oven Program |
60 °C to 246 °C at 3 °C/min. |
| InChI |
InChI=1S/C14H18O3/c1-9(2)7-10-8-12-11(13(15)16-10)5-6-14(3,4)17-12/h5-6,8-9H,7H2,1-4H3 |
| InChIKey |
YPRGBPOJDMIJCQ-UHFFFAOYSA-N |
| Molecular Weight |
234.295 g/mol |
| Nominal Mass |
234 u |
| Number of Peaks |
172 |
| SMILES |
C=1(OC(C2=C(C1)OC(C=C2)(C)C)=O)CC(C)C |
| SPLASH |
splash10-014i-9470000000-f74c2f57cfe8fbd5f29b |
| Source |
part of name is missing! |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA001170 |
