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BPLKZYGVNXWVSN-RZHVNCANSA-M
SpectraBase Compound ID F9E6Of98mc5
InChI InChI=1S/C16H27N2O.HI/c1-18-8-3-2-6-15(18)12-9-13(11-18)14-5-4-7-16(19)17(14)10-12;/h12-15H,2-11H2,1H3;1H/q+1;/p-1/t12-,13-,14+,15-,18?;/m0./s1
InChIKey BPLKZYGVNXWVSN-RZHVNCANSA-M
Mol Weight 390.31 g/mol
Molecular Formula C16H27IN2O
Exact Mass 390.116808 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4R5VPM6VO0C
Name BPLKZYGVNXWVSN-RZHVNCANSA-M
Compound Number (A2-18).J
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H27IN2O
InChI InChI=1S/C16H27N2O.HI/c1-18-8-3-2-6-15(18)12-9-13(11-18)14-5-4-7-16(19)17(14)10-12;/h12-15H,2-11H2,1H3;1H/q+1;/p-1/t12-,13-,14+,15-,18?;/m0./s1
InChIKey BPLKZYGVNXWVSN-RZHVNCANSA-M
Literature Reference Author B.MIKHOVA,H.DUDDECK
Literature Reference Citation MAGN.RES.CHEM.,36,779(1998)
Literature Reference DOI 10.1002/(sici)1097-458x(1998110)36:11<779::aid-omr374>3.3.co;2-r
Molecular Weight 390.308 g/mol
Solvent DMSO-D6