| SpectraBase Spectrum ID |
ItWs9mGQEPC |
| Name |
2-(3-Methyl-1-oxobutyl)-3-[(3,6-dioxooctahydropyrazino[4,5-a]pyrrol-2-yl)methyl]indole |
| Alternate Name(s) |
2-{[2-(3-methylbutanoyl)-1H-indol-3-yl]methyl}tetrahydropyrrolo[1,2-a]pyrazine-3,6(2H,4H)-dione |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H25N3O3 |
| InChI |
InChI=1S/C21H25N3O3/c1-13(2)9-18(25)21-16(15-5-3-4-6-17(15)22-21)11-23-10-14-7-8-19(26)24(14)12-20(23)27/h3-6,13-14,22H,7-12H2,1-2H3 |
| InChIKey |
UJNXZQFAQFUVBR-UHFFFAOYSA-N |
| Molecular Weight |
367.449 g/mol |
| SMILES |
[nH]1c2c(c(c1C(CC(C)C)=O)CN1C(CN3C(C1)CCC3=O)=O)cccc2 |
| SPLASH |
splash10-0a4i-0902000000-606d61909181788eddf2 |
| Source of Spectrum |
E1-37-29-45 |
| Wiley ID |
1517537 |
![2-(3-Methyl-1-oxobutyl)-3-[(3,6-dioxooctahydropyrazino[4,5-a]pyrrol-2-yl)methyl]indole](/api/spectrum/ItWs9mGQEPC/structure.png?h=300&w=458 "2-(3-Methyl-1-oxobutyl)-3-[(3,6-dioxooctahydropyrazino[4,5-a]pyrrol-2-yl)methyl]indole")
