SpectraBase Compound ID | Ie0JX1c78MR |
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InChI | InChI=1S/C11H16F5NO3/c1-4-5-7(8(18)20-6(2)3)17-9(19)10(12,13)11(14,15)16/h6-7H,4-5H2,1-3H3,(H,17,19)/t7-/m0/s1 |
InChIKey | JMRHRSQXUPGQAE-ZETCQYMHSA-N |
Mol Weight | 305.25 g/mol |
Molecular Formula | C11H16F5NO3 |
Exact Mass | 305.105034 g/mol |
SpectraBase Spectrum ID | Exvax6qqFT8 |
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Name | N-Pentafluoropropionyl-L-norvaline isopropyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 305.105034191 u |
Formula | C11H16F5NO3 |
InChI | InChI=1S/C11H16F5NO3/c1-4-5-7(8(18)20-6(2)3)17-9(19)10(12,13)11(14,15)16/h6-7H,4-5H2,1-3H3,(H,17,19)/t7-/m0/s1 |
InChIKey | JMRHRSQXUPGQAE-ZETCQYMHSA-N |
Molecular Weight | 305.245 g/mol |
SMILES | CCC[C@](NC(=O)C(F)(F)C(F)(F)F)(C(OC(C)C)=O)[H] |