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4-Chloro-6-[(c-2,c-8-diphenyl-3,7-dioxa-r-1-azabicyclo[3.3.0]oct-c-5-yl)methoxy]pyrimidine
SpectraBase Compound ID 72zFE4YkOUs
InChI InChI=1S/C22H20ClN3O3/c23-18-11-19(25-15-24-18)27-12-22-13-28-20(16-7-3-1-4-8-16)26(22)21(29-14-22)17-9-5-2-6-10-17/h1-11,15,20-21H,12-14H2/t20-,21+,22-
InChIKey OTRRZUWUDVXMKX-KOUNCHBCSA-N
Mol Weight 409.87 g/mol
Molecular Formula C22H20ClN3O3
Exact Mass 409.119319 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1tmezv2ZBF9
Name 4-Chloro-6-[(c-2,c-8-diphenyl-3,7-dioxa-r-1-azabicyclo[3.3.0]oct-c-5-yl)methoxy]pyrimidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H20ClN3O3
InChI InChI=1S/C22H20ClN3O3/c23-18-11-19(25-15-24-18)27-12-22-13-28-20(16-7-3-1-4-8-16)26(22)21(29-14-22)17-9-5-2-6-10-17/h1-11,15,20-21H,12-14H2/t20-,21+,22-
InChIKey OTRRZUWUDVXMKX-KOUNCHBCSA-N
Molecular Weight 409.873 g/mol
SMILES [C@]12(N([C@](OC2)(c2ccccc2)[H])[C@@](OC1)(c1ccccc1)[H])COc1ncnc(c1)Cl
SPLASH splash10-0uk9-1926000000-a9b041310518b7e00ea4
Source of Spectrum F-62-7336-6
Wiley ID 1640110