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N-(2C-T-4) Fentanyl

View entire compound with spectra: 1 MS (GC)

N-(2C-T-4) Fentanyl
SpectraBase Compound ID FVuO9ytamS5
InChI InChI=1S/C27H38N2O3S/c1-6-27(30)29(22-10-8-7-9-11-22)23-13-16-28(17-14-23)15-12-21-18-25(32-5)26(33-20(2)3)19-24(21)31-4/h7-11,18-20,23H,6,12-17H2,1-5H3
InChIKey XUHDOFPVQOMQAX-UHFFFAOYSA-N
Mol Weight 470.7 g/mol
Molecular Formula C27H38N2O3S
Exact Mass 470.260314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3fLDSiMz4qb
Name N-(2C-T-4) Fentanyl
Catalog Number 28981
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H38N2O3S
InChI InChI=1S/C27H38N2O3S/c1-6-27(30)29(22-10-8-7-9-11-22)23-13-16-28(17-14-23)15-12-21-18-25(32-5)26(33-20(2)3)19-24(21)31-4/h7-11,18-20,23H,6,12-17H2,1-5H3
InChIKey XUHDOFPVQOMQAX-UHFFFAOYSA-N
Molecular Weight 470.672 g/mol
SMILES CCC(N(c1ccccc1)C1CCN(CCc2c(OC)cc(SC(C)C)c(OC)c2)CC1)=O
SPLASH splash10-0002-4980000000-bb7331ffde8eb2aa01e8
Source of Spectrum CAY-2023-313-0
Wiley ID 1888279