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5-MeO-2-Me-DALT HFB

View entire compound with spectra: 1 NMR, and 1 MS (GC)

5-MeO-2-Me-DALT HFB
SpectraBase Compound ID 6AzYta38yUQ
InChI InChI=1S/C22H23F7N2O2/c1-5-10-30(11-6-2)12-9-16-14(3)31(18-8-7-15(33-4)13-17(16)18)19(32)20(23,24)21(25,26)22(27,28)29/h5-8,13H,1-2,9-12H2,3-4H3
InChIKey ASKSECCYSBXTIT-UHFFFAOYSA-N
Mol Weight 480.43 g/mol
Molecular Formula C22H23F7N2O2
Exact Mass 480.164775 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Lm9acJ0qID9
Name 5-meo-2-me-Dalt hfb P1634
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 480.164775128 u
Formula C22H23F7N2O2
InChI InChI=1S/C22H23F7N2O2/c1-5-10-30(11-6-2)12-9-16-14(3)31(18-8-7-15(33-4)13-17(16)18)19(32)20(23,24)21(25,26)22(27,28)29/h5-8,13H,1-2,9-12H2,3-4H3
InChIKey ASKSECCYSBXTIT-UHFFFAOYSA-N
Molecular Weight 480.427 g/mol
SMILES C=1(C=C2C(=C(N(C2=CC1)C(=O)C(F)(F)C(F)(F)C(F)(F)F)C)CCN(CC=C)CC=C)OC