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N,N-bis-Phenethyl-2,3-methylenedioxyamphetamine

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

N,N-bis-Phenethyl-2,3-methylenedioxyamphetamine
SpectraBase Compound ID 1U24szTTHTJ
InChI InChI=1S/C26H29NO2/c1-21(19-24-13-8-14-25-26(24)29-20-28-25)27(17-15-22-9-4-2-5-10-22)18-16-23-11-6-3-7-12-23/h2-14,21H,15-20H2,1H3
InChIKey JALJUSWWHGENEV-UHFFFAOYSA-N
Mol Weight 387.52 g/mol
Molecular Formula C26H29NO2
Exact Mass 387.219829 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EiXpTiftoJd
Name N,N-bis-Phenethyl-2,3-methylenedioxyamphetamine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 387.219829176 u
Formula C26H29NO2
InChI InChI=1S/C26H29NO2/c1-21(19-24-13-8-14-25-26(24)29-20-28-25)27(17-15-22-9-4-2-5-10-22)18-16-23-11-6-3-7-12-23/h2-14,21H,15-20H2,1H3
InChIKey JALJUSWWHGENEV-UHFFFAOYSA-N
Molecular Weight 387.523 g/mol
SMILES C=1(C2=C(OCO2)C=CC1)CC(N(CCC=1C=CC=CC1)CCC1=CC=CC=C1)C