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(5aRS,9aSR)-1-tert-butyl-5,5,8-trimethyl-3-phenyl-3,5,5a,6,7,9a-hexahydro[2]benzopyrano[3,4-c]pyrazole
SpectraBase Compound ID 5RjIMfCW1Dp
InChI InChI=1S/C23H30N2O/c1-15-12-13-18-17(14-15)19-20(22(2,3)4)24-25(16-10-8-7-9-11-16)21(19)26-23(18,5)6/h7-11,14,17-18H,12-13H2,1-6H3
InChIKey IFCWVEMFUJXAMR-UHFFFAOYSA-N
Mol Weight 350.51 g/mol
Molecular Formula C23H30N2O
Exact Mass 350.235814 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5GQE1Pjnpjg
Name (5aRS,9aSR)-1-tert-butyl-5,5,8-trimethyl-3-phenyl-3,5,5a,6,7,9a-hexahydro[2]benzopyrano[3,4-c]pyrazole
CAS Registry Number 112297-10-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H30N2O
InChI InChI=1S/C23H30N2O/c1-15-12-13-18-17(14-15)19-20(22(2,3)4)24-25(16-10-8-7-9-11-16)21(19)26-23(18,5)6/h7-11,14,17-18H,12-13H2,1-6H3
InChIKey IFCWVEMFUJXAMR-UHFFFAOYSA-N
Molecular Weight 350.506 g/mol
SMILES c12c([n](-c3ccccc3)nc1C(C)(C)C)OC(C1C2C=C(CC1)C)(C)C
SPLASH splash10-0frx-6097000000-79e8c437d209f63bba76
Source of Spectrum J-53-819-29
Wiley ID 1342313