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1,4-Butanediamine, N1-(2-nitrophenyl)-, 2tms derivative

View entire compound with spectra: 1 NMR

1,4-Butanediamine, N1-(2-nitrophenyl)-, 2tms derivative
SpectraBase Compound ID 5bq8UBOTH8n
InChI InChI=1S/C16H31N3O2Si2/c1-22(2,3)18(23(4,5)6)14-10-9-13-17-15-11-7-8-12-16(15)19(20)21/h7-8,11-12,17H,9-10,13-14H2,1-6H3
InChIKey WDOZZPRHULBVAY-UHFFFAOYSA-N
Mol Weight 353.61 g/mol
Molecular Formula C16H31N3O2Si2
Exact Mass 353.19548 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EmHTVePmId4
Name 1,4-Butanediamine, N1-(2-nitrophenyl)-, 2tms derivative
Comments Computed using HOSE algorithm
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Exact Mass 353.195480318 u
Formula C16H31N3O2Si2
InChI InChI=1S/C16H31N3O2Si2/c1-22(2,3)18(23(4,5)6)14-10-9-13-17-15-11-7-8-12-16(15)19(20)21/h7-8,11-12,17H,9-10,13-14H2,1-6H3
InChIKey WDOZZPRHULBVAY-UHFFFAOYSA-N
Molecular Weight 353.613 g/mol
SMILES C1(N(=O)=O)=C(C=CC=C1)NCCCCN([Si](C)(C)C)[Si](C)(C)C