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Fenethylline
SpectraBase Compound ID 7SCK6ej75Bn
InChI InChI=1S/C18H23N5O2/c1-13(11-14-7-5-4-6-8-14)19-9-10-23-12-20-16-15(23)17(24)22(3)18(25)21(16)2/h4-8,12-13,19H,9-11H2,1-3H3
InChIKey NMCHYWGKBADVMK-UHFFFAOYSA-N
Mol Weight 341.42 g/mol
Molecular Formula C18H23N5O2
Exact Mass 341.185175 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8TD7FYqpFw4
Name Fenethylline
Alternate Name(s) Captagon Phenethylline (RS)-1,3-dimethyl- 7-[2-(1-phenylpropan-2-ylamino)ethyl]purine- 2,6-dione 1,3-Dimethyl-7-(2-((1-phenylpropan-2-yl)amino)ethyl)-3,7-dihydro-1H-purine-2,6-dione
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Formula C18H23N5O2
InChI InChI=1S/C18H23N5O2/c1-13(11-14-7-5-4-6-8-14)19-9-10-23-12-20-16-15(23)17(24)22(3)18(25)21(16)2/h4-8,12-13,19H,9-11H2,1-3H3
InChIKey NMCHYWGKBADVMK-UHFFFAOYSA-N
Molecular Weight 341.415 g/mol
SMILES N(C(Cc1ccccc1)C)CC[n]1cnc2N(C)C(N(C)C(=O)c12)=O
SPLASH splash10-0udi-9480000000-25b0f646e914e2545ca2
Source of Spectrum SWG-33-2799-0
Wiley ID 1809820