| SpectraBase Spectrum ID |
HysqguQDjHT |
| Name |
1-cyclohepta-1,3,5-trienecarboxylic acid ethyl ester |
| Alternate Name(s) |
Ethyl 1,3,5-Cycloheptatriene-1-carboxylate
cyclohepta-1,3,5-triene-1-carboxylic acid ethyl ester
ethyl cyclohepta-1,3,5-triene-1-carboxylate |
| CAS Registry Number |
27332-40-7 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C10H12O2 |
| InChI |
InChI=1S/C10H12O2/c1-2-12-10(11)9-7-5-3-4-6-8-9/h3-7H,2,8H2,1H3 |
| InChIKey |
JHNJOJBFADEHLK-UHFFFAOYSA-N |
| Molecular Weight |
164.204 g/mol |
| SMILES |
C(C1=CC=CC=CC1)(=O)OCC |
| SPLASH |
splash10-0006-9100000000-9820f4097ecfac4705f8 |
| Source of Spectrum |
AJ-66-278-12 |
| Wiley ID |
771946 |
