| SpectraBase Spectrum ID |
GcwZMbxWtKZ |
| Name |
2-Butenoic acid, 4-(2-iodo-4,5-dimethylphenoxy)-, ethyl ester |
| CAS Registry Number |
111726-52-4 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H17IO3 |
| InChI |
InChI=1S/C14H17IO3/c1-4-17-14(16)6-5-7-18-13-9-11(3)10(2)8-12(13)15/h5-6,8-9H,4,7H2,1-3H3/b6-5+ |
| InChIKey |
SMLGCPKRGQKKEU-AATRIKPKSA-N |
| Molecular Weight |
360.191 g/mol |
| SMILES |
c1(c(cc(c(c1)C)C)OC\C=C\C(=O)OCC)I |
| SPLASH |
splash10-03dj-0089000000-17835d63789ce6dbf8f3 |
| Source of Spectrum |
I-65-2022-6 |
| Synonyms |
ethyl (2E)-4-(2-iodo-4,5-dimethylphenoxy)-2-butenoate
Ethyl-4-(2'-iodo-4',5'-dimethyl)phenylbutanoate |
| Wiley ID |
1348010 |
