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N-[4-(10,11-Dihydro-5H-dibenzo[b,f]azepin-5-yl)-3-methylbutyl]-N,N-diethylamine
SpectraBase Compound ID 5G6w27q8jaN
InChI InChI=1S/C23H32N2/c1-4-24(5-2)17-16-19(3)18-25-22-12-8-6-10-20(22)14-15-21-11-7-9-13-23(21)25/h6-13,19H,4-5,14-18H2,1-3H3
InChIKey XLQUYYGJNNRSPA-UHFFFAOYSA-N
Mol Weight 336.5 g/mol
Molecular Formula C23H32N2
Exact Mass 336.256549 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9JKmwRm8rxO
Name N-[4-(10,11-Dihydro-5H-dibenzo[B,F]azepin-5-yl)-3-methylbutyl]-N,N-diethylamine
Comments Computed using HOSE algorithm
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Exact Mass 336.256549038 u
Formula C23H32N2
InChI InChI=1S/C23H32N2/c1-4-24(5-2)17-16-19(3)18-25-22-12-8-6-10-20(22)14-15-21-11-7-9-13-23(21)25/h6-13,19H,4-5,14-18H2,1-3H3
InChIKey XLQUYYGJNNRSPA-UHFFFAOYSA-N
Molecular Weight 336.523 g/mol
SMILES C=12N(C=3C(CCC2=CC=CC1)=CC=CC3)CC(CCN(CC)CC)C