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2,4(1H,3H)-Pyrimidinedione, 1-[4-(phenylmethoxy)-3-[(phenylmethoxy)methyl]butyl]-

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2,4(1H,3H)-Pyrimidinedione, 1-[4-(phenylmethoxy)-3-[(phenylmethoxy)methyl]butyl]-
SpectraBase Compound ID B4HmdAPa25
InChI InChI=1S/C23H26N2O4/c26-22-12-14-25(23(27)24-22)13-11-21(17-28-15-19-7-3-1-4-8-19)18-29-16-20-9-5-2-6-10-20/h1-10,12,14,21H,11,13,15-18H2,(H,24,26,27)
InChIKey LQTVFBKESZTVJN-UHFFFAOYSA-N
Mol Weight 394.47 g/mol
Molecular Formula C23H26N2O4
Exact Mass 394.189257 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EAuSN34IBFm
Name 2,4(1H,3H)-Pyrimidinedione, 1-[4-(phenylmethoxy)-3-[(phenylmethoxy)methyl]butyl]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 394.189257321 u
Formula C23H26N2O4
InChI InChI=1S/C23H26N2O4/c26-22-12-14-25(23(27)24-22)13-11-21(17-28-15-19-7-3-1-4-8-19)18-29-16-20-9-5-2-6-10-20/h1-10,12,14,21H,11,13,15-18H2,(H,24,26,27)
InChIKey LQTVFBKESZTVJN-UHFFFAOYSA-N
Molecular Weight 394.471 g/mol
SMILES C(OCC(CCN1C=CC(NC1=O)=O)COCC=1C=CC=CC1)C1=CC=CC=C1