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2(1H)-Pyrimidinone, 1,1'-(2-methoxy-1,3-phenylene)bis[tetrahydro-3-(2,2,6-trimethyl-4H-1, 3-benzodioxin-8-yl)-
SpectraBase Compound ID 39IZBpxXReX
InChI InChI=1S/C37H44N4O7/c1-23-17-25-21-45-36(3,4)47-31(25)29(19-23)40-15-9-13-38(34(40)42)27-11-8-12-28(33(27)44-7)39-14-10-16-41(35(39)43)30-20-24(2)18-26-22-46-37(5,6)48-32(26)30/h8,11-12,17-20H,9-10,13-16,21-22H2,1-7H3
InChIKey GMEFZXNRYMMQMZ-UHFFFAOYSA-N
Mol Weight 656.8 g/mol
Molecular Formula C37H44N4O7
Exact Mass 656.321 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EPqNz845ILB
Name 2(1H)-Pyrimidinone, 1,1'-(2-methoxy-1,3-phenylene)bis[tetrahydro-3-(2,2,6-trimethyl-4H-1, 3-benzodioxin-8-yl)-
Alternate Name(s) 1,1'-(2-Methoxy-1,3-phenylene)bis(tetrahydro-3-(2,2,6-trimethyl)-4H-1,3-benzodioxin-8-yl)-2(1H)-pyrimidinone 1-[2-methoxy-3-(2-oxo-3-(2,2,6-trimethyl-4H-1,3-benzodioxin-8-yl)tetrahydro-1(2H)-pyrimidinyl)phenyl]-3-(2,2,6-trimethyl-4H-1,3-benzodioxin-8-yl)tetrahydro-2(1H)-pyrimidinone 4H-1,3-benzodioxin, 2(1H)-pyrimidinone deriv.
CAS Registry Number 91084-89-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C37H44N4O7
InChI InChI=1S/C37H44N4O7/c1-23-17-25-21-45-36(3,4)47-31(25)29(19-23)40-15-9-13-38(34(40)42)27-11-8-12-28(33(27)44-7)39-14-10-16-41(35(39)43)30-20-24(2)18-26-22-46-37(5,6)48-32(26)30/h8,11-12,17-20H,9-10,13-16,21-22H2,1-7H3
InChIKey GMEFZXNRYMMQMZ-UHFFFAOYSA-N
Molecular Weight 656.780 g/mol
SMILES C1(N(c2c3c(COC(O3)(C)C)cc(c2)C)CCCN1c1c(c(N2C(N(c3c4c(COC(O4)(C)C)cc(c3)C)CCC2)=O)ccc1)OC)=O
SPLASH splash10-052f-9000000000-21f91689fffcc73b7032
Source of Spectrum C-106-4985-0
Wiley ID 1413375