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3-tert-Butyl-7-(3,4,5-trimethoxybenzyl)-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-(3,4,5-trimethoxybenzyl)-1-phenyl-1,4,6,7-tetrahydropyrazolo[3,4-d][1,3]oxazine
SpectraBase Compound ID 4rslbmt4YyF
InChI InChI=1S/C25H31N3O4/c1-25(2,3)23-19-15-32-16-27(24(19)28(26-23)18-10-8-7-9-11-18)14-17-12-20(29-4)22(31-6)21(13-17)30-5/h7-13H,14-16H2,1-6H3
InChIKey VPQZLQGHGDOPJL-UHFFFAOYSA-N
Mol Weight 437.54 g/mol
Molecular Formula C25H31N3O4
Exact Mass 437.231456 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8r1bxU56lBY
Name 3-tert-Butyl-7-(3,4,5-trimethoxybenzyl)-1-phenyl-1,4,6,7-tetrahydropyrazolo[3,4-d][1,3]oxazine
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H31N3O4
InChI InChI=1S/C25H31N3O4/c1-25(2,3)23-19-15-32-16-27(24(19)28(26-23)18-10-8-7-9-11-18)14-17-12-20(29-4)22(31-6)21(13-17)30-5/h7-13H,14-16H2,1-6H3
InChIKey VPQZLQGHGDOPJL-UHFFFAOYSA-N
Molecular Weight 437.540 g/mol
SMILES c12[n](nc(c2COCN1Cc1cc(OC)c(c(c1)OC)OC)C(C)(C)C)-c1ccccc1
SPLASH splash10-001i-0900000000-2c80bf6558dc2db7dee4
Source of Spectrum U1-2010-6462-16k
Synonyms 3-tert-butyl-1-phenyl-7-[(3,4,5-trimethoxyphenyl)methyl]-4,6-dihydropyrazolo[3,4-d][1,3]oxazine
Wiley ID 1664658