| SpectraBase Spectrum ID |
5w6LNEuoFsj |
| Name |
Methyl 2-(3',3'-dimethyl-1'-butyn-1'-yl)-1-cyclohexenecarboxylate |
| Alternate Name(s) |
methyl 2-(3,3-dimethyl-1-butynyl)-1-cyclohexene-1-carboxylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H20O2 |
| InChI |
InChI=1S/C14H20O2/c1-14(2,3)10-9-11-7-5-6-8-12(11)13(15)16-4/h5-8H2,1-4H3 |
| InChIKey |
DTHSTMXTAFBPNJ-UHFFFAOYSA-N |
| Molecular Weight |
220.312 g/mol |
| SMILES |
C(#CC(C)(C)C)C1=C(C(=O)OC)CCCC1 |
| SPLASH |
splash10-0a4i-0090000000-ab6953182535ab088170 |
| Source of Spectrum |
K-128-857-25 |
| Wiley ID |
1220268 |
