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(R)-7-Methoxy-3-methyl-1,2,3,4-tetrahydrobenzo[4,5]imidazo[1,2-a]pyridine
SpectraBase Compound ID 6nVWfQKIfl2
InChI InChI=1S/C13H16N2O/c1-9-5-6-15-12-4-3-10(16-2)8-11(12)14-13(15)7-9/h3-4,8-9H,5-7H2,1-2H3/t9-/m1/s1
InChIKey CTCRJJMLNANMNQ-SECBINFHSA-N
Mol Weight 216.28 g/mol
Molecular Formula C13H16N2O
Exact Mass 216.126263 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9t7C0E0eihX
Name (R)-7-Methoxy-3-methyl-1,2,3,4-tetrahydrobenzo[4,5]imidazo[1,2-a]pyridine
Appearance White solid
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Formula C13H16N2O
InChI InChI=1S/C13H16N2O/c1-9-5-6-15-12-4-3-10(16-2)8-11(12)14-13(15)7-9/h3-4,8-9H,5-7H2,1-2H3/t9-/m1/s1
InChIKey CTCRJJMLNANMNQ-SECBINFHSA-N
Instrument Name Jeol AccuTOF
Ionization Type EI
Literature Reference DOI 10.1002/anie.201813191
Molecular Weight 216.284 g/mol
Optical Rotation [a]D20 = +56 (c = 1.00, CHCl3)
Reported Formula C13H16N2O
SMILES c1(cc2c(cc1)[n]1c(n2)C[C@@](CC1)(C)[H])OC
SPLASH splash10-0uxr-0390000000-d234bfbca112cef55764
Sample Comments er = 1:99
Source of Spectrum ACI-58-SM29-2c
Wiley ID 1840709