| SpectraBase Spectrum ID |
49LBeXnAFhS |
| Name |
3-(3-keto-3-methoxy-propyl)-4-methyl-5-[(Z)-(3,3,5-trimethyl-1-pyrrolin-2-ylidene)methyl]-1H-pyrrole-2-carboxylic acid tert-butyl ester |
| CAS Registry Number |
121103-72-8 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H32N2O4 |
| InChI |
InChI=1S/C22H32N2O4/c1-13-12-22(6,7)17(23-13)11-16-14(2)15(9-10-18(25)27-8)19(24-16)20(26)28-21(3,4)5/h11,24H,9-10,12H2,1-8H3/b17-11- |
| InChIKey |
KZOXDFKZBYQDCS-BOPFTXTBSA-N |
| Molecular Weight |
388.508 g/mol |
| SMILES |
[nH]1c(c(c(c1\C=C\1N=C(C)CC1(C)C)C)CCC(=O)OC)C(OC(C)(C)C)=O |
| SPLASH |
splash10-001i-0009000000-71b542bea3379cff1c82 |
| Source of Spectrum |
KC-1989-276-68 |
| Synonyms |
3-(3-methoxy-3-oxopropyl)-4-methyl-5-[(Z)-(2,4,4-trimethyl-3H-pyrrol-5-ylidene)methyl]-1H-pyrrole-2-carboxylic acid tert-butyl ester
tert-butyl 3-(3-methoxy-3-oxidanylidene-propyl)-4-methyl-5-[(Z)-(2,4,4-trimethyl-3H-pyrrol-5-ylidene)methyl]-1H-pyrrole-2-carboxylate
tert-butyl 3-(3-methoxy-3-oxo-propyl)-4-methyl-5-[(Z)-(2,4,4-trimethyl-3H-pyrrol-5-ylidene)methyl]-1H-pyrrole-2-carboxylate |
| Wiley ID |
1363906 |
![3-(3-keto-3-methoxy-propyl)-4-methyl-5-[(Z)-(3,3,5-trimethyl-1-pyrrolin-2-ylidene)methyl]-1H-pyrrole-2-carboxylic acid tert-butyl ester](/api/spectrum/49LBeXnAFhS/structure.png?h=300&w=458 "3-(3-keto-3-methoxy-propyl)-4-methyl-5-[(Z)-(3,3,5-trimethyl-1-pyrrolin-2-ylidene)methyl]-1H-pyrrole-2-carboxylic acid tert-butyl ester")
