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Eseroline, (1'-phenethyl)carbamate(ester) (1'S)-

View entire compound with spectra: 1 NMR

Eseroline, (1'-phenethyl)carbamate(ester) (1'S)-
SpectraBase Compound ID 62coFukPU14
InChI InChI=1S/C22H27N3O2/c1-15(16-8-6-5-7-9-16)23-21(26)27-17-10-11-19-18(14-17)22(2)12-13-24(3)20(22)25(19)4/h5-11,14-15,20H,12-13H2,1-4H3,(H,23,26)
InChIKey RPHIVFMKHUAHHX-UHFFFAOYSA-N
Mol Weight 365.48 g/mol
Molecular Formula C22H27N3O2
Exact Mass 365.210327 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IewIxc19K1A
Name Eseroline, (1'-phenethyl)carbamate(ester) (1'S)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 365.210327119 u
Formula C22H27N3O2
InChI InChI=1S/C22H27N3O2/c1-15(16-8-6-5-7-9-16)23-21(26)27-17-10-11-19-18(14-17)22(2)12-13-24(3)20(22)25(19)4/h5-11,14-15,20H,12-13H2,1-4H3,(H,23,26)
InChIKey RPHIVFMKHUAHHX-UHFFFAOYSA-N
Molecular Weight 365.477 g/mol
SMILES C1=C(C=C2C(=C1)N(C)C1C2(CCN1C)C)OC(NC(C)C1=CC=CC=C1)=O