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DIFENOXIN-ARTIFACT 1
SpectraBase Compound ID CX8RVtBgsO
InChI InChI=1S/C27H28N2/c28-22-27(25-12-6-2-7-13-25,26-14-8-3-9-15-26)18-21-29-19-16-24(17-20-29)23-10-4-1-5-11-23/h1-15,24H,16-21H2
InChIKey VEFWRMMQEHDNJT-UHFFFAOYSA-N
Mol Weight 380.54 g/mol
Molecular Formula C27H28N2
Exact Mass 380.225249 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LoiO76gOGJ8
Name DIFENOXIN-ARTIFACT 1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C27H28N2
InChI InChI=1S/C27H28N2/c28-22-27(25-12-6-2-7-13-25,26-14-8-3-9-15-26)18-21-29-19-16-24(17-20-29)23-10-4-1-5-11-23/h1-15,24H,16-21H2
InChIKey VEFWRMMQEHDNJT-UHFFFAOYSA-N
Instrument Name GC
Molecular Weight 380.535 g/mol
SMILES c1ccc(C(C#N)(CCN2CCC(c3ccccc3)CC2)c2ccccc2)cc1
SPLASH splash10-00di-3911000000-0e48351e811f04ebe6d0
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany