| SpectraBase Spectrum ID |
FlPXhPsPZ2I |
| Name |
2-(6-methyl-7-oxo-1-cyclohepta-2,4-dienyl)acetic acid tert-butyl ester |
| CAS Registry Number |
115912-62-4 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H20O3 |
| InChI |
InChI=1S/C14H20O3/c1-10-7-5-6-8-11(13(10)16)9-12(15)17-14(2,3)4/h5-8,10-11H,9H2,1-4H3 |
| InChIKey |
BDKYUFYFHIXZHN-UHFFFAOYSA-N |
| Molecular Weight |
236.311 g/mol |
| SMILES |
C1(C(CC(OC(C)(C)C)=O)C=CC=CC1C)=O |
| SPLASH |
splash10-0a4i-9200000000-a4fc65a738b05a39e8f8 |
| Source of Spectrum |
J-53-4597-0 |
| Synonyms |
2-(7-keto-6-methyl-cyclohepta-2,4-dien-1-yl)acetic acid tert-butyl ester
tert-butyl (6-methyl-7-oxo-2,4-cycloheptadien-1-yl)acetate
tert-butyl 2-(6-methyl-7-oxidanylidene-cyclohepta-2,4-dien-1-yl)ethanoate
tert-butyl 2-(6-methyl-7-oxo-cyclohepta-2,4-dien-1-yl)acetate |
| Wiley ID |
1238407 |
