| SpectraBase Spectrum ID |
KoeoexsHlSs |
| Name |
1,5-Cyclohexadiene-1-acetic acid, 5-(3,3-dimethyl-1-butynyl)-.alpha.,.alpha.-dimethyl-, methyl ester |
| CAS Registry Number |
134055-92-8 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H24O2 |
| InChI |
InChI=1S/C17H24O2/c1-16(2,3)11-10-13-8-7-9-14(12-13)17(4,5)15(18)19-6/h9,12H,7-8H2,1-6H3 |
| InChIKey |
GLSHVAYCORXPPY-UHFFFAOYSA-N |
| Molecular Weight |
260.377 g/mol |
| SMILES |
C=1(C(C(=O)OC)(C)C)C=C(C#CC(C)(C)C)CCC1 |
| SPLASH |
splash10-0bt9-0960000000-a069bce7b4e5c88333a7 |
| Source of Spectrum |
C-113-3909-37 |
| Synonyms |
1-[(methoxycarbonyl)(dimethyl)methyl]-3-[(t-butyl)ethynyl]-4,5-dihydrobenzene
methyl 2-[5-(3,3-dimethyl-1-butynyl)-1,5-cyclohexadien-1-yl]-2-methylpropanoate |
| Wiley ID |
1264185 |
