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Spectral Data   Additional Data   Download  
Molecule
10022073
Chemical name(s)2,2-dimethyl-4-(2-oxopyridin-1-yl)chromene-6-carbonitrile
Chemical formulaC17H14N2O2
Molecular weight278.305
Number of double bond equivalents (DBEs)12.0
Number of all rings, size of smallest set of smallest rings4, 3
Canonical name(s)
CAS-Number
Additional information
Links from Unichem: ChEMBL;PubChem ('Drugs of the Future' subset);ZINC;IBM strategic IP insight platform and the National Institutes of Health;FDA/USP Substance Registration System (SRS);SureChEMBL;PubChem ('... (truncated)
Molecule keywords
DOI
13C Spectrum
10060367 Rating: 10
Type13C
Measurement conditions
Temperature [K]Unreported
SolventUnreported
Field Strength [MHz]Unreported
Assignment MethodUnreported
Literature
Additional comments585.MOL.3; Multiplicities generated automatically from H count
Additional information
Spectrum categoriesocmainz inhouse database



Spectral Data   Additional Data   Download  
Type: 1H Unreported Double click to get resizeable window!
Atom
No. ⇓
Mult.(coupling const.)
Meas.
Shift
1-H 6.92
3-H 7.65
4-H 7.03
8-H 6.13
10-H 7.56
11-H 6.36
12-H 7.58
13-H 6.49
16-H 1.50
17-H 1.54

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