| SpectraBase Compound ID | BOBA3EF1sa5 |
|---|---|
| InChI | InChI=1S/C8H15N3O4.C2HF3O2/c1-4(10-6(12)3-9)7(13)11-5(2)8(14)15;3-2(4,5)1(6)7/h4-5H,3,9H2,1-2H3,(H,10,12)(H,11,13)(H,14,15);(H,6,7)/p+1/t4-,5-;/m0./s1 |
| InChIKey | CJUJSLLVUWFZEJ-FHAQVOQBSA-O |
| Mol Weight | 332.256 g/mol |
| Molecular Formula | C10H17F3N3O6 |
| Exact Mass | 332.106945 g/mol |
15N Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E3LEwiPxRD3 |
|---|---|
| Name | GLYCYLALANYLALANINE-TRIFLUOROACETATE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C10H17F3N3O6 |
| InChI | InChI=1S/C8H15N3O4.C2HF3O2/c1-4(10-6(12)3-9)7(13)11-5(2)8(14)15;3-2(4,5)1(6)7/h4-5H,3,9H2,1-2H3,(H,10,12)(H,11,13)(H,14,15);(H,6,7)/p+1/t4-,5-;/m0./s1 |
| InChIKey | CJUJSLLVUWFZEJ-FHAQVOQBSA-O |
| Literature Reference Author | H.R.KRICHELDORF |
| Literature Reference Citation | ORG.MAGN.RES.,15,162(1981) |
| Literature Reference DOI | 10.1002/mrc.1270150211 |
| Solvent | HCOOH |
| Source File Reference | UWCS17543 |