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(+)-(1R,2R,3S)-2-(1-N-butyl-2-isobutylcarbonyloxy-3-methoxymethoxybutyl)-4,5-diphenyloxazole

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

(+)-(1R,2R,3S)-2-(1-N-butyl-2-isobutylcarbonyloxy-3-methoxymethoxybutyl)-4,5-diphenyloxazole
SpectraBase Compound ID ANract6eVBm
InChI InChI=1S/C30H39NO5/c1-6-7-18-25(28(22(4)34-20-33-5)35-26(32)19-21(2)3)30-31-27(23-14-10-8-11-15-23)29(36-30)24-16-12-9-13-17-24/h8-17,21-22,25,28H,6-7,18-20H2,1-5H3/t22-,25+,28-/m0/s1
InChIKey OOQUBDUTCVCNGA-DLNIMUOOSA-N
Mol Weight 493.6 g/mol
Molecular Formula C30H39NO5
Exact Mass 493.282823 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AEwV1rA5vaA
Name (+)-(1R,2R,3S)-2-(1-N-butyl-2-isobutylcarbonyloxy-3-methoxymethoxybutyl)-4,5-diphenyloxazole
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 493.282823355 u
Formula C30H39NO5
InChI InChI=1S/C30H39NO5/c1-6-7-18-25(28(22(4)34-20-33-5)35-26(32)19-21(2)3)30-31-27(23-14-10-8-11-15-23)29(36-30)24-16-12-9-13-17-24/h8-17,21-22,25,28H,6-7,18-20H2,1-5H3/t22-,25+,28-/m0/s1
InChIKey OOQUBDUTCVCNGA-DLNIMUOOSA-N
Molecular Weight 493.644 g/mol
SMILES C1(=NC(C=2C=CC=CC2)=C(O1)C1=CC=CC=C1)[C@@]([C@@](OC(=O)CC(C)C)([C@@](OCOC)(C)[H])[H])(CCCC)[H]