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N-(2C-B) Fentanyl

View entire compound with spectra: 1 MS (GC)

N-(2C-B) Fentanyl
SpectraBase Compound ID 8iiKSntVsqV
InChI InChI=1S/C24H31BrN2O3/c1-4-24(28)27(19-8-6-5-7-9-19)20-11-14-26(15-12-20)13-10-18-16-23(30-3)21(25)17-22(18)29-2/h5-9,16-17,20H,4,10-15H2,1-3H3
InChIKey IWJDXHKRMXYRFD-UHFFFAOYSA-N
Mol Weight 475.43 g/mol
Molecular Formula C24H31BrN2O3
Exact Mass 474.151806 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DL7wPYnzEsS
Name N-(2C-B) Fentanyl
Catalog Number 28970
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H31BrN2O3
InChI InChI=1S/C24H31BrN2O3/c1-4-24(28)27(19-8-6-5-7-9-19)20-11-14-26(15-12-20)13-10-18-16-23(30-3)21(25)17-22(18)29-2/h5-9,16-17,20H,4,10-15H2,1-3H3
InChIKey IWJDXHKRMXYRFD-UHFFFAOYSA-N
Molecular Weight 475.427 g/mol
SMILES CCC(N(c1ccccc1)C1CCN(CCc2c(OC)cc(Br)c(OC)c2)CC1)=O
SPLASH splash10-0002-5980000000-ecc1defbdfcfee7aec58
Source of Spectrum CAY-2023-89-0
Wiley ID 1888055