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N-(DOB) Fentanyl

View entire compound with spectra: 1 MS (GC)

N-(DOB) Fentanyl
SpectraBase Compound ID JiyKgJuUHn3
InChI InChI=1S/C25H33BrN2O3/c1-5-25(29)28(20-9-7-6-8-10-20)21-11-13-27(14-12-21)18(2)15-19-16-24(31-4)22(26)17-23(19)30-3/h6-10,16-18,21H,5,11-15H2,1-4H3
InChIKey NVCARFLHKMIFTK-UHFFFAOYSA-N
Mol Weight 489.5 g/mol
Molecular Formula C25H33BrN2O3
Exact Mass 488.167456 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BTZxFbVd4Qa
Name N-(DOB) Fentanyl
Catalog Number 28986
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H33BrN2O3
InChI InChI=1S/C25H33BrN2O3/c1-5-25(29)28(20-9-7-6-8-10-20)21-11-13-27(14-12-21)18(2)15-19-16-24(31-4)22(26)17-23(19)30-3/h6-10,16-18,21H,5,11-15H2,1-4H3
InChIKey NVCARFLHKMIFTK-UHFFFAOYSA-N
Molecular Weight 489.454 g/mol
SMILES CCC(N(c1ccccc1)C1CCN(C(C)Cc2c(OC)cc(Br)c(OC)c2)CC1)=O
SPLASH splash10-0a4i-3490000000-e7220577544ea84f6089
Source of Spectrum CAY-2023-333-0
Wiley ID 1888299