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2-[1-(Dimethylamino)-3-phenyl-2-propynyl]benzoic acid ethyl ester
SpectraBase Compound ID HmbGZr07Zhj
InChI InChI=1S/C20H21NO2/c1-4-23-20(22)18-13-9-8-12-17(18)19(21(2)3)15-14-16-10-6-5-7-11-16/h5-13,19H,4H2,1-3H3
InChIKey VXDFOFAWFFSQMO-UHFFFAOYSA-N
Mol Weight 307.39 g/mol
Molecular Formula C20H21NO2
Exact Mass 307.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F2exgHQP570
Name 2-[1-(Dimethylamino)-3-phenyl-2-propynyl]benzoic acid ethyl ester
Alternate Name(s) 2-[1-(Dimethylamino)-3-phenyl-2-propyyl]benzoic acid Ethyl Ester Ethyl 2-[1-(dimethylamino)-3-phenyl-2-propynyl]benzoate
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Formula C20H21NO2
InChI InChI=1S/C20H21NO2/c1-4-23-20(22)18-13-9-8-12-17(18)19(21(2)3)15-14-16-10-6-5-7-11-16/h5-13,19H,4H2,1-3H3
InChIKey VXDFOFAWFFSQMO-UHFFFAOYSA-N
Molecular Weight 307.393 g/mol
SMILES C(C(c1c(C(=O)OCC)cccc1)N(C)C)#Cc1ccccc1
SPLASH splash10-01sj-0390000000-01311ed0288ad4146b53
Source of Spectrum C5-2002-2146-4
Wiley ID 1615094