| SpectraBase Compound ID | LubnNS0Fqs |
|---|---|
| InChI | InChI=1S/C12H20O2/c1-11(2,3)8-7-9(12(4,5)6)14-10(8)13/h7,9H,1-6H3 |
| InChIKey | ULYNNVZMDHDFDB-UHFFFAOYSA-N |
| Mol Weight | 196.29 g/mol |
| Molecular Formula | C12H20O2 |
| Exact Mass | 196.14633 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1Th2n9cr3Wk |
|---|---|
| Name | 2,4-Ditert-butyl-2H-furan-5-one |
| CAS Registry Number | 53904-87-3 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H20O2 |
| InChI | InChI=1S/C12H20O2/c1-11(2,3)8-7-9(12(4,5)6)14-10(8)13/h7,9H,1-6H3 |
| InChIKey | ULYNNVZMDHDFDB-UHFFFAOYSA-N |
| Molecular Weight | 196.290 g/mol |
| SMILES | C=1(C(OC(C1)C(C)(C)C)=O)C(C)(C)C |
| SPLASH | splash10-004l-0900000000-08f02733174d90848fa9 |
| Source of Spectrum | SB-31-559-0 |
| Wiley ID | 1193402 |