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N-(3-Bromobenzyl)-N-(2-methoxyphenyl)-1-(2-phenylethyl)piperidin-4-amine
SpectraBase Compound ID DIQpRMR8rjm
InChI InChI=1S/C27H31BrN2O/c1-31-27-13-6-5-12-26(27)30(21-23-10-7-11-24(28)20-23)25-15-18-29(19-16-25)17-14-22-8-3-2-4-9-22/h2-13,20,25H,14-19,21H2,1H3
InChIKey IDFMFMKUMHYPCO-UHFFFAOYSA-N
Mol Weight 479.46 g/mol
Molecular Formula C27H31BrN2O
Exact Mass 478.161977 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8FHwVoYTNzc
Name N-(3-Bromobenzyl)-N-(2-methoxyphenyl)-1-(2-phenylethyl)piperidin-4-amine
Classification Fentalogue
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 478.161976625 u
Formula C27H31BrN2O
InChI InChI=1S/C27H31BrN2O/c1-31-27-13-6-5-12-26(27)30(21-23-10-7-11-24(28)20-23)25-15-18-29(19-16-25)17-14-22-8-3-2-4-9-22/h2-13,20,25H,14-19,21H2,1H3
InChIKey IDFMFMKUMHYPCO-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 479.462 g/mol
Nominal Mass 478 u
Quality 993
Retention Index 3409
SMILES C=1(N(C2CCN(CC2)CCC2=CC=CC=C2)CC2=CC(=CC=C2)Br)C(=CC=CC1)OC
SPLASH splash10-000b-8916000000-96ce7a55f735a813be2d
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-propionyl+(3-bromobenzyl)-phenyl+(2-methoxyphenyl))
Technique GC/MS
Wiley ID DD2024_033873