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3-tert-Butyl-7-(4-chlorobenzyl)-1-phenyl-1,4,6,7-tetrahydropyrazolo-[3,4-d][1,3]oxazine

View entire compound with spectra: 1 MS (GC)

3-tert-Butyl-7-(4-chlorobenzyl)-1-phenyl-1,4,6,7-tetrahydropyrazolo-[3,4-d][1,3]oxazine
SpectraBase Compound ID 5kO4WaET1LP
InChI InChI=1S/C22H24ClN3O/c1-22(2,3)20-19-14-27-15-25(13-16-9-11-17(23)12-10-16)21(19)26(24-20)18-7-5-4-6-8-18/h4-12H,13-15H2,1-3H3
InChIKey NSXUNMSZWJWKMY-UHFFFAOYSA-N
Mol Weight 381.91 g/mol
Molecular Formula C22H24ClN3O
Exact Mass 381.16079 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5WaIING0eXd
Name 3-tert-Butyl-7-(4-chlorobenzyl)-1-phenyl-1,4,6,7-tetrahydropyrazolo-[3,4-d][1,3]oxazine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24ClN3O
InChI InChI=1S/C22H24ClN3O/c1-22(2,3)20-19-14-27-15-25(13-16-9-11-17(23)12-10-16)21(19)26(24-20)18-7-5-4-6-8-18/h4-12H,13-15H2,1-3H3
InChIKey NSXUNMSZWJWKMY-UHFFFAOYSA-N
Molecular Weight 381.907 g/mol
SMILES c12[n](nc(c2COCN1Cc1ccc(cc1)Cl)C(C)(C)C)-c1ccccc1
SPLASH splash10-0059-0639000000-1ba2ecf24c69dd5e9c2a
Source of Spectrum U1-2010-6461-16j
Synonyms 3-tert-Butyl-7-[(4-chlorophenyl)methyl]-1-phenyl-4,6-dihydropyrazolo[3,4-d][1,3]oxazine
Wiley ID 1664659