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Methyl 12,12,13,13,14,14,15,15,15-nonafluoroentadecanecarboxylate

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Methyl 12,12,13,13,14,14,15,15,15-nonafluoroentadecanecarboxylate
SpectraBase Compound ID 6SchxkLw0mY
InChI InChI=1S/C16H23F9O2/c1-27-12(26)10-8-6-4-2-3-5-7-9-11-13(17,18)14(19,20)15(21,22)16(23,24)25/h2-11H2,1H3
InChIKey YQIHSWVCDAYLFB-UHFFFAOYSA-N
Mol Weight 418.34 g/mol
Molecular Formula C16H23F9O2
Exact Mass 418.155433 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E57wwWNKGJu
Name Methyl 12,12,13,13,14,14,15,15,15-nonafluoroentadecanecarboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 418.155433446 u
Formula C16H23F9O2
InChI InChI=1S/C16H23F9O2/c1-27-12(26)10-8-6-4-2-3-5-7-9-11-13(17,18)14(19,20)15(21,22)16(23,24)25/h2-11H2,1H3
InChIKey YQIHSWVCDAYLFB-UHFFFAOYSA-N
Molecular Weight 418.344 g/mol
SMILES C(C(C(F)(F)CCCCCCCCCCC(=O)OC)(F)F)(C(F)(F)F)(F)F