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Phentolamine 2AC
SpectraBase Compound ID K1VOPPJDhyb
InChI InChI=1S/C21H23N3O3/c1-15-7-9-18(10-8-15)24(14-21-22-11-12-23(21)16(2)25)19-5-4-6-20(13-19)27-17(3)26/h4-10,13H,11-12,14H2,1-3H3
InChIKey XRMSOMLUSVRZKD-UHFFFAOYSA-N
Mol Weight 365.43 g/mol
Molecular Formula C21H23N3O3
Exact Mass 365.173942 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B4djnQYP6Gm
Name 3-[N-[(1-acetyl-4,5-dihydro-1H-imidazol-2-yl)methyl]-N-(4-methylphenyl)amino]-1-acetoxybenzene
Alternate Name(s) 3-{[(1-acetyl-4,5-dihydro-1H-imidazol-2-yl)methyl]-4-methylanilino}phenyl acetate
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Formula C21H23N3O3
InChI InChI=1S/C21H23N3O3/c1-15-7-9-18(10-8-15)24(14-21-22-11-12-23(21)16(2)25)19-5-4-6-20(13-19)27-17(3)26/h4-10,13H,11-12,14H2,1-3H3
InChIKey XRMSOMLUSVRZKD-UHFFFAOYSA-N
Molecular Weight 365.433 g/mol
SMILES C=1(N(C(=O)C)CCN1)CN(c1cc(OC(=O)C)ccc1)c1ccc(cc1)C
SPLASH splash10-0002-3934000000-6695c7006e4cebcf1e57
Source of Spectrum CJ-1992-0-0
Wiley ID 1351440