| SpectraBase Compound ID | 1bdaBAhRa6y |
|---|---|
| InChI | InChI=1S/C13H20O/c1-5-7-11(14)12-10(2)8-6-9-13(12,3)4/h5,7H,6,8-9H2,1-4H3/b7-5+ |
| InChIKey | BGTBFNDXYDYBEY-FNORWQNLSA-N |
| Mol Weight | 192.3 g/mol |
| Molecular Formula | C13H20O |
| Exact Mass | 192.151415 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3cQVpsMUULQ |
|---|---|
| Name | 2-Buten-1-one, 1-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, (E)- |
| CAS Registry Number | 23726-91-2 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H20O |
| InChI | InChI=1S/C13H20O/c1-5-7-11(14)12-10(2)8-6-9-13(12,3)4/h5,7H,6,8-9H2,1-4H3/b7-5+ |
| InChIKey | BGTBFNDXYDYBEY-FNORWQNLSA-N |
| Molecular Weight | 192.302 g/mol |
| SMILES | C1(=C(CCCC1(C)C)C)C(\C=C\C)=O |
| SPLASH | splash10-00bc-6900000000-6ada6534ffc6476c5bd8 |
| Source of Spectrum | PR-657-0-0 |
| Synonyms | (E)-1-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2-buten-1-one (E)-1-(2,6,6-trimethyl-1-cyclohexenyl)-2-buten-1-one (E)-1-(2,6,6-trimethylcyclohex-1-enyl)-2-buten-1-one (E)-1-(2,6,6-trimethylcyclohexen-1-yl)but-2-en-1-one 3-Buten-1-one, 4-[2,6,6-trimethyl-1(or 2)-cyclohexen-1-yl]- .beta.-damascone 2-Buten-1-one, 1-(2,6,6-trimethyl-1-cyclohexen-1-yl)- 2-Buten-1-one, 1-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, (2E)- 2-Buten-1-one, 1-(2,6,6-trimethylcyclohex-1-enyl)-, (E)- Rose dihydroketone BRN 2046078 EINECS 245-842-1 FEMA 3243 |
| Wiley ID | 1189036 |