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Benzenepropanamine, 4-(1,1-dimethylethyl)-beta-methyl-N-(1,1,2-trimethylpropyl)-

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Benzenepropanamine, 4-(1,1-dimethylethyl)-beta-methyl-N-(1,1,2-trimethylpropyl)-
SpectraBase Compound ID XLIRo53bOp
InChI InChI=1S/C20H35N/c1-15(2)20(7,8)21-14-16(3)13-17-9-11-18(12-10-17)19(4,5)6/h9-12,15-16,21H,13-14H2,1-8H3
InChIKey ZQGMZXWETKKNSA-UHFFFAOYSA-N
Mol Weight 289.5 g/mol
Molecular Formula C20H35N
Exact Mass 289.27695 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FgVW0lIsHsR
Name Benzenepropanamine, 4-(1,1-dimethylethyl)-beta-methyl-N-(1,1,2-trimethylpropyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 289.276950131 u
Formula C20H35N
InChI InChI=1S/C20H35N/c1-15(2)20(7,8)21-14-16(3)13-17-9-11-18(12-10-17)19(4,5)6/h9-12,15-16,21H,13-14H2,1-8H3
InChIKey ZQGMZXWETKKNSA-UHFFFAOYSA-N
Molecular Weight 289.507 g/mol
SMILES N(CC(CC1=CC=C(C=C1)C(C)(C)C)C)C(C(C)C)(C)C