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1,1,2,2-Tetramethyl-3-oxo-1,8b-dihydro-2H-4-oxa-cyclobuta[a]naphthalene-2a-carbonitrile
SpectraBase Compound ID EPXZMTGMviO
InChI InChI=1S/C16H17NO2/c1-14(2)12-10-7-5-6-8-11(10)19-13(18)16(12,9-17)15(14,3)4/h5-8,12H,1-4H3
InChIKey BIQAEQIGYUVPFC-UHFFFAOYSA-N
Mol Weight 255.32 g/mol
Molecular Formula C16H17NO2
Exact Mass 255.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 26XnkRypjEh
Name 1,1,2,2-Tetramethyl-3-oxo-1,8b-dihydro-2H-4-oxa-cyclobuta[a]naphthalene-2a-carbonitrile
Alternate Name(s) 1,1,2,2-Tetramethyl-2-oxo-1,2,2a,3-tetrahydro-8bH-cyclobuta[c]benzopyran-2a-carbonitrile 1,1,2,2-tetramethyl-3-oxo-1,8b-dihydro-2H-cyclobuta[c]chromene-2a(3H)-carbonitrile
Comments Less than 3 mono-isotopic peaks
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Formula C16H17NO2
InChI InChI=1S/C16H17NO2/c1-14(2)12-10-7-5-6-8-11(10)19-13(18)16(12,9-17)15(14,3)4/h5-8,12H,1-4H3
InChIKey BIQAEQIGYUVPFC-UHFFFAOYSA-N
Molecular Weight 255.317 g/mol
SMILES C12(C(C)(C)C(C2c2c(cccc2)OC1=O)(C)C)C#N
SPLASH splash10-001i-9000000000-aa740a688a14c442d0f1
Source of Spectrum H-82-180-13
Wiley ID 754419