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(Z)-1,1-Dimethylethyl 3-amino-3-{7'-(4"-methoxyphenylbicyclo[4.2.0]octa-1',3',5'-trien-7'-yl)propenoate
SpectraBase Compound ID FL4Km5dbiaM
InChI InChI=1S/C22H25NO3/c1-21(2,3)26-20(24)13-19(23)22(14-15-7-5-6-8-18(15)22)16-9-11-17(25-4)12-10-16/h5-13H,14,23H2,1-4H3/b19-13-
InChIKey BSVNYUSKYSBCNO-UYRXBGFRSA-N
Mol Weight 351.45 g/mol
Molecular Formula C22H25NO3
Exact Mass 351.183444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1wGQygbo5P
Name (Z)-1,1-Dimethylethyl 3-amino-3-{7'-(4"-methoxyphenylbicyclo[4.2.0]octa-1',3',5'-trien-7'-yl)propenoate
Alternate Name(s) (Z)-1,1-Dimethylethyl 3-amino-3-{7'-(4''-methoxyphenylbicyclo[4.2.0]octa-1',3',5'-trien-7'-yl)propenoate
Comments Less than 3 mono-isotopic peaks
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Formula C22H25NO3
InChI InChI=1S/C22H25NO3/c1-21(2,3)26-20(24)13-19(23)22(14-15-7-5-6-8-18(15)22)16-9-11-17(25-4)12-10-16/h5-13H,14,23H2,1-4H3/b19-13-
InChIKey BSVNYUSKYSBCNO-UYRXBGFRSA-N
Molecular Weight 351.446 g/mol
SMILES N\C(C1(c2c(cccc2)C1)c1ccc(cc1)OC)=C/C(OC(C)(C)C)=O
SPLASH splash10-0002-0090000000-4ea2e0dbfd1ae2cdb917
Source of Spectrum KC-1992-3115-13
Wiley ID 777351