| SpectraBase Spectrum ID |
1iq5fYvLeRU |
| Name |
3-Benzoyl-4-(3,3-ethylenedioxypropyl)-5-isopropyl-2-methylpyrrole |
| Alternate Name(s) |
{4-[2-(1,3-dioxolan-2-yl)ethyl]-5-isopropyl-2-methyl-1H-pyrrol-3-yl}(phenyl)methanone |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H25NO3 |
| InChI |
InChI=1S/C20H25NO3/c1-13(2)19-16(9-10-17-23-11-12-24-17)18(14(3)21-19)20(22)15-7-5-4-6-8-15/h4-8,13,17,21H,9-12H2,1-3H3 |
| InChIKey |
ZKFOIEQRMDRKQG-UHFFFAOYSA-N |
| Molecular Weight |
327.424 g/mol |
| SMILES |
[nH]1c(c(c(c1C)C(=O)c1ccccc1)CCC1OCCO1)C(C)C |
| SPLASH |
splash10-0a4i-0903000000-d0d116875f8244d9442b |
| Source of Spectrum |
F-55-6564-24 |
| Wiley ID |
838042 |
