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3-Isopropoxy-1,2-propanediol, bis(1-naphthalenecarbamate)

View entire compound with spectra: 2 NMR, and 1 FTIR

3-Isopropoxy-1,2-propanediol, bis(1-naphthalenecarbamate)
SpectraBase Compound ID J0DAcwimVx
InChI InChI=1S/C28H28N2O5/c1-19(2)33-17-22(35-28(32)30-26-16-8-12-21-10-4-6-14-24(21)26)18-34-27(31)29-25-15-7-11-20-9-3-5-13-23(20)25/h3-16,19,22H,17-18H2,1-2H3,(H,29,31)(H,30,32)
InChIKey UVVKHKWXGGROGH-UHFFFAOYSA-N
Mol Weight 472.54 g/mol
Molecular Formula C28H28N2O5
Exact Mass 472.199822 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Gzsl9nH9Jf2
Name 3-Isopropoxy-1,2-propanediol, bis(1-naphthalenecarbamate)
Comments Computed using HOSE algorithm
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Exact Mass 472.199822005 u
Formula C28H28N2O5
InChI InChI=1S/C28H28N2O5/c1-19(2)33-17-22(35-28(32)30-26-16-8-12-21-10-4-6-14-24(21)26)18-34-27(31)29-25-15-7-11-20-9-3-5-13-23(20)25/h3-16,19,22H,17-18H2,1-2H3,(H,29,31)(H,30,32)
InChIKey UVVKHKWXGGROGH-UHFFFAOYSA-N
Molecular Weight 472.541 g/mol
SMILES N(C1=C2C=CC=CC2=CC=C1)C(OC(COC(NC=1C=CC=C2C=CC=CC12)=O)COC(C)C)=O