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Me(3)-13C-(5-Methoxy-1,3-dimethyl-2-oxo-2,3-dihydro-1H-indol-3-yl)acetonitrile
SpectraBase Compound ID 1nt97tIf4He
InChI InChI=1S/C13H14N2O2/c1-13(6-7-14)10-8-9(17-3)4-5-11(10)15(2)12(13)16/h4-5,8H,6H2,1-3H3/i1+1
InChIKey KCTADLCDIAPGCN-OUBTZVSYSA-N
Mol Weight 231.26 g/mol
Molecular Formula C1213CH14N2O2
Exact Mass 231.108883 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GFV7zmIO692
Name Me(3)-13C-(5-Methoxy-1,3-dimethyl-2-oxo-2,3-dihydro-1H-indol-3-yl)acetonitrile
Comments Original formula: C12[13C]H14N2O2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14N2O2
InChI InChI=1S/C13H14N2O2/c1-13(6-7-14)10-8-9(17-3)4-5-11(10)15(2)12(13)16/h4-5,8H,6H2,1-3H3/i1+1
InChIKey KCTADLCDIAPGCN-OUBTZVSYSA-N
Molecular Weight 231.259 g/mol
SMILES [13CH3]C1(C(N(c2ccc(cc12)OC)C)=O)CC#N
SPLASH splash10-000x-0940000000-579f14165dcf1fac227b
Source of Spectrum O1-63-1136-6
Wiley ID 1592612