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3-Indolethanamine, N-[(.beta.-T-butyramino)propionyl]-

View entire compound with spectra: 1 NMR

3-Indolethanamine, N-[(.beta.-T-butyramino)propionyl]-
SpectraBase Compound ID 8aro2ThcYC2
InChI InChI=1S/C19H27N3O4/c1-19(2,3)18(24)26-22-10-8-17(23)20-9-7-13-12-21-16-6-5-14(25-4)11-15(13)16/h5-6,11-12,21-22H,7-10H2,1-4H3,(H,20,23)
InChIKey MRPBGVPOIHJSNT-UHFFFAOYSA-N
Mol Weight 361.44 g/mol
Molecular Formula C19H27N3O4
Exact Mass 361.200156 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C2qnMa8p66N
Name 3-Indolethanamine, N-[(.beta.-T-butyramino)propionyl]-
Comments Computed using HOSE algorithm
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Exact Mass 361.200156357 u
Formula C19H27N3O4
InChI InChI=1S/C19H27N3O4/c1-19(2,3)18(24)26-22-10-8-17(23)20-9-7-13-12-21-16-6-5-14(25-4)11-15(13)16/h5-6,11-12,21-22H,7-10H2,1-4H3,(H,20,23)
InChIKey MRPBGVPOIHJSNT-UHFFFAOYSA-N
Molecular Weight 361.442 g/mol
SMILES C1=C(C=C2C(=C1)NC=C2CCNC(=O)CCNOC(=O)C(C)(C)C)OC