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

View entire compound with spectra: 1 MS (GC)

7-(4-Bromobenzyl)-3-tert-butyl-1-phenyl-1,4,6,7-tetrahydropyrazolo[3,4-d][1,3]-oxazine
SpectraBase Compound ID C3FCyHIYsjN
InChI InChI=1S/C22H24BrN3O/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 ULPNHEGUXUHBDK-UHFFFAOYSA-N
Mol Weight 426.36 g/mol
Molecular Formula C22H24BrN3O
Exact Mass 425.110275 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID uMQMTTbef9
Name 7-(4-Bromobenzyl)-3-tert-butyl-1-phenyl-1,4,6,7-tetrahydropyrazolo[3,4-d][1,3]-oxazine
Alternate Name(s) 7-[(4-bromophenyl)methyl]-3-tert-butyl-1-phenyl-4,6-dihydropyrazolo[3,4-d][1,3]oxazine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24BrN3O
InChI InChI=1S/C22H24BrN3O/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 ULPNHEGUXUHBDK-UHFFFAOYSA-N
Molecular Weight 426.358 g/mol
SMILES c12[n](nc(c2COCN1Cc1ccc(cc1)Br)C(C)(C)C)-c1ccccc1
SPLASH splash10-056r-0390800000-23ea6ec2859dbd9301e3
Source of Spectrum U1-2010-6460-16c
Wiley ID 1664665