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3,4-difluoro U-47700
SpectraBase Compound ID Ag8G8gbZlP1
InChI InChI=1S/C16H22F2N2O/c1-19(2)14-6-4-5-7-15(14)20(3)16(21)11-8-9-12(17)13(18)10-11/h8-10,14-15H,4-7H2,1-3H3/t14-,15-/m0/s1
InChIKey NKTBCDDEERGNEI-GJZGRUSLSA-N
Mol Weight 296.36 g/mol
Molecular Formula C16H22F2N2O
Exact Mass 296.17002 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F5HItEZFujg
Name 3,4-difluoro U-47700
Catalog Number 28689
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22F2N2O
InChI InChI=1S/C16H22F2N2O/c1-19(2)14-6-4-5-7-15(14)20(3)16(21)11-8-9-12(17)13(18)10-11/h8-10,14-15H,4-7H2,1-3H3/t14-,15-/m0/s1
InChIKey NKTBCDDEERGNEI-GJZGRUSLSA-N
Molecular Weight 296.362 g/mol
SMILES c1(F)c(ccc(C(N(C)[C@]2(CCCC[C@@]2(N(C)C)[H])[H])=O)c1)F
SPLASH splash10-003r-9700000000-248e74c8ccbf1548cd56
Source of Spectrum CAY-2023-293-0
Wiley ID 1888259