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5-MeO-2-Me-EiPT HFB

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

5-MeO-2-Me-EiPT HFB
SpectraBase Compound ID 8snAxfvG3zi
InChI InChI=1S/C21H25F7N2O2/c1-6-29(12(2)3)10-9-15-13(4)30(17-8-7-14(32-5)11-16(15)17)18(31)19(22,23)20(24,25)21(26,27)28/h7-8,11-12H,6,9-10H2,1-5H3
InChIKey IKUSKKATLHNFQO-UHFFFAOYSA-N
Mol Weight 470.43 g/mol
Molecular Formula C21H25F7N2O2
Exact Mass 470.180425 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BG3fjflxeYO
Name 5-meo-2-me-Eipt hfb P1618
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 470.180425192 u
Formula C21H25F7N2O2
InChI InChI=1S/C21H25F7N2O2/c1-6-29(12(2)3)10-9-15-13(4)30(17-8-7-14(32-5)11-16(15)17)18(31)19(22,23)20(24,25)21(26,27)28/h7-8,11-12H,6,9-10H2,1-5H3
InChIKey IKUSKKATLHNFQO-UHFFFAOYSA-N
Molecular Weight 470.432 g/mol
SMILES C1(OC)=CC=C2C(=C1)C(CCN(C(C)C)CC)=C(C)N2C(=O)C(F)(F)C(F)(F)C(F)(F)F