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ETHYL-ALANYLGLYCYLGLYCINE-TRIFLUOROACETATE
SpectraBase Compound ID 5WnMGWTe0ar
InChI InChI=1S/C9H17N3O4.C2HF3O2/c1-3-16-8(14)5-11-7(13)4-12-9(15)6(2)10;3-2(4,5)1(6)7/h6H,3-5,10H2,1-2H3,(H,11,13)(H,12,15);(H,6,7)/t6-;/m0./s1
InChIKey IKHRVMADUCXWPD-RGMNGODLSA-N
Mol Weight 345.275 g/mol
Molecular Formula C11H18F3N3O6
Exact Mass 345.11477 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KBRgvkdtpte
Name ETHYL-ALANYLGLYCYLGLYCINE-TRIFLUOROACETATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H18F3N3O6
InChI InChI=1S/C9H17N3O4.C2HF3O2/c1-3-16-8(14)5-11-7(13)4-12-9(15)6(2)10;3-2(4,5)1(6)7/h6H,3-5,10H2,1-2H3,(H,11,13)(H,12,15);(H,6,7)/t6-;/m0./s1
InChIKey IKHRVMADUCXWPD-RGMNGODLSA-N
Literature Reference Author H.R.KRICHELDORF
Literature Reference Citation ORG.MAGN.RES.,15,162(1981)
Literature Reference DOI 10.1002/mrc.1270150211
Solvent TFA
Source File Reference UWCS17548