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Eseroline, 4'-methylphenylcarbamate(ester)

View entire compound with spectra: 1 NMR, and 1 FTIR

Eseroline, 4'-methylphenylcarbamate(ester)
SpectraBase Compound ID LeDU1bEGCs8
InChI InChI=1S/C21H25N3O2/c1-14-5-7-15(8-6-14)22-20(25)26-16-9-10-18-17(13-16)21(2)11-12-23(3)19(21)24(18)4/h5-10,13,19H,11-12H2,1-4H3,(H,22,25)
InChIKey HSSFUESYZZQIIN-UHFFFAOYSA-N
Mol Weight 351.45 g/mol
Molecular Formula C21H25N3O2
Exact Mass 351.194677 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GvzUTgoXUHI
Name Eseroline, 4'-methylphenylcarbamate(ester)
Comments Computed using HOSE algorithm
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Exact Mass 351.194677055 u
Formula C21H25N3O2
InChI InChI=1S/C21H25N3O2/c1-14-5-7-15(8-6-14)22-20(25)26-16-9-10-18-17(13-16)21(2)11-12-23(3)19(21)24(18)4/h5-10,13,19H,11-12H2,1-4H3,(H,22,25)
InChIKey HSSFUESYZZQIIN-UHFFFAOYSA-N
Molecular Weight 351.450 g/mol
SMILES C1(=CC=C(C=C1)C)NC(OC1=CC2=C(C=C1)N(C)C1C2(CCN1C)C)=O