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bis(1'1-Dimethylethyl) [3-(1H-indolyl)propyl]-imidodicarbonate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

bis(1'1-Dimethylethyl) [3-(1H-indolyl)propyl]-imidodicarbonate
SpectraBase Compound ID 2bFy40j5FB6
InChI InChI=1S/C21H30N2O4/c1-20(2,3)26-18(24)23(19(25)27-21(4,5)6)14-9-13-22-15-12-16-10-7-8-11-17(16)22/h7-8,10-12,15H,9,13-14H2,1-6H3
InChIKey CAHAIFWRPFNAOK-UHFFFAOYSA-N
Mol Weight 374.48 g/mol
Molecular Formula C21H30N2O4
Exact Mass 374.220557 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ix39mOATUVr
Name bis(1'1-Dimethylethyl) [3-(1H-indolyl)propyl]-imidodicarbonate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 374.220557450 u
Formula C21H30N2O4
InChI InChI=1S/C21H30N2O4/c1-20(2,3)26-18(24)23(19(25)27-21(4,5)6)14-9-13-22-15-12-16-10-7-8-11-17(16)22/h7-8,10-12,15H,9,13-14H2,1-6H3
InChIKey CAHAIFWRPFNAOK-UHFFFAOYSA-N
Molecular Weight 374.481 g/mol
SMILES C(N(C(OC(C)(C)C)=O)CCCN1C=CC2=C1C=CC=C2)(OC(C)(C)C)=O