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(.+/-.)-N-propyl-3,4-methylenedioxyamphetamine, N-(trifluoroacetyl)

View entire compound with spectra: 1 NMR

(.+/-.)-N-propyl-3,4-methylenedioxyamphetamine, N-(trifluoroacetyl)
SpectraBase Compound ID 5ISD5L11nW7
InChI InChI=1S/C15H18F3NO3/c1-3-6-19(14(20)15(16,17)18)10(2)7-11-4-5-12-13(8-11)22-9-21-12/h4-5,8,10H,3,6-7,9H2,1-2H3
InChIKey ZWRCWQFLSYGXKW-UHFFFAOYSA-N
Mol Weight 317.31 g/mol
Molecular Formula C15H18F3NO3
Exact Mass 317.123878 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HPhzklwkHry
Name (.+/-.)-N-propyl-3,4-methylenedioxyamphetamine, N-(trifluoroacetyl)
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 317.123877930 u
Formula C15H18F3NO3
InChI InChI=1S/C15H18F3NO3/c1-3-6-19(14(20)15(16,17)18)10(2)7-11-4-5-12-13(8-11)22-9-21-12/h4-5,8,10H,3,6-7,9H2,1-2H3
InChIKey ZWRCWQFLSYGXKW-UHFFFAOYSA-N
Molecular Weight 317.308 g/mol
SMILES C1(=CC=C2C(=C1)OCO2)CC(C)N(CCC)C(C(F)(F)F)=O