| SpectraBase Spectrum ID |
4TizsaTRfgr |
| Name |
5-iodo-3-(3-keto-3-methoxy-propyl)-4-methyl-1H-pyrrole-2-carboxylic acid tert-butyl ester |
| Alternate Name(s) |
5-iodo-3-(3-methoxy-3-oxopropyl)-4-methyl-1H-pyrrole-2-carboxylic acid tert-butyl ester
tert-butyl 5-iodanyl-3-(3-methoxy-3-oxidanylidene-propyl)-4-methyl-1H-pyrrole-2-carboxylate
tert-butyl 5-iodo-3-(3-methoxy-3-oxo-propyl)-4-methyl-1H-pyrrole-2-carboxylate |
| CAS Registry Number |
31837-48-6 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H20INO4 |
| InChI |
InChI=1S/C14H20INO4/c1-8-9(6-7-10(17)19-5)11(16-12(8)15)13(18)20-14(2,3)4/h16H,6-7H2,1-5H3 |
| InChIKey |
UAAPYXOFVYQZQQ-UHFFFAOYSA-N |
| Molecular Weight |
393.221 g/mol |
| SMILES |
[nH]1c(c(c(c1C(OC(C)(C)C)=O)CCC(=O)OC)C)I |
| SPLASH |
splash10-000l-0009000000-6242f97c71928c9c669e |
| Source of Spectrum |
KC-1985-1705-0 |
| Wiley ID |
1366141 |
