(2S,3S)-2-Amino-3-methylpentanoic acid,...
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN_ReSpect-PS028003
Dataset description:
This MassBank record with Accession MSBNK-RIKEN_ReSpect-PS028003 contains the MS2 mass spectrum of (2S,3S)-2-Amino-3-methylpentanoic acid, L-Isoleucine, iLe,...
Source: (2S,3S)-2-Amino-3-methylpentanoic acid, L-Isoleucine, iLe, alpha-Amino-beta-methylvaleric acid
Chemical Info
| InChI | InChI=1S/C6H13NO2/c1-3-4(2)5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9) |
|---|---|
| SMILES | CCC(C)C(C(=O)O)N |
| InChI Key | AGPKZVBTJJNPAG-UHFFFAOYSA-N |
| Molecular Formula | C6H13NO2 |
| Exact Mass | 131.175 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | January 11, 2024 |
| Metadata last updated | January 11, 2024 |
| Created | January 11, 2024 |
| Format | HTML |
| License | Attribution-NonCommercial 4.0 International (CC BY-NC 4.0) |
| Id | fda2ad60-14cd-4b70-8344-30fbd6f4d77d |
| Package id | msbnk-riken_respect-ps028003 |
| Resource type | HTML |
| State | active |