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N,N-Bis(2-methylbutyl)-2-fluorophenethylamine
SpectraBase Compound ID oSzgHj3cRD
InChI InChI=1S/C18H30FN/c1-5-15(3)13-20(14-16(4)6-2)12-11-17-9-7-8-10-18(17)19/h7-10,15-16H,5-6,11-14H2,1-4H3
InChIKey ZGSRTBDHJXPMCI-UHFFFAOYSA-N
Mol Weight 279.44 g/mol
Molecular Formula C18H30FN
Exact Mass 279.236228 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Av3ZKjlU19b
Name N,N-bis(2-Methylbutyl)-2-fluorophenethylamine
Comments Computed using HOSE algorithm
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Exact Mass 279.236228133 u
Formula C18H30FN
InChI InChI=1S/C18H30FN/c1-5-15(3)13-20(14-16(4)6-2)12-11-17-9-7-8-10-18(17)19/h7-10,15-16H,5-6,11-14H2,1-4H3
InChIKey ZGSRTBDHJXPMCI-UHFFFAOYSA-N
Molecular Weight 279.443 g/mol
SMILES C=1(C(=CC=CC1)F)CCN(CC(CC)C)CC(CC)C