| SpectraBase Spectrum ID |
Cf51x4U9X13 |
| Name |
5-Keto-5-[4-[(5-keto-5-methoxy-pentanoyl)amino]butylamino]valeric acid methyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
344.194736624 u |
| Formula |
C16H28N2O6 |
| InChI |
InChI=1S/C16H28N2O6/c1-23-15(21)9-5-7-13(19)17-11-3-4-12-18-14(20)8-6-10-16(22)24-2/h3-12H2,1-2H3,(H,17,19)(H,18,20) |
| InChIKey |
AFCINSNXFLEVNR-UHFFFAOYSA-N |
| Molecular Weight |
344.408 g/mol |
| SMILES |
C(=O)(NCCCCNC(=O)CCCC(=O)OC)CCCC(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.978163 |
![5-Keto-5-[4-[(5-keto-5-methoxy-pentanoyl)amino]butylamino]valeric acid methyl ester](/api/spectrum/Cf51x4U9X13/structure.png?h=300&w=458 "5-Keto-5-[4-[(5-keto-5-methoxy-pentanoyl)amino]butylamino]valeric acid methyl ester")
