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Spectral Data   Additional Data   Download  
Molecule
10016020
Chemical name(s)naphthalen-2-ol
Chemical formulaC10H8O
Molecular weight144.17
Number of double bond equivalents (DBEs)7.0
Number of all rings, size of smallest set of smallest rings3, 2
Canonical name(s)
CAS-Number 135-19-3
Additional information ChEBI;
Links from Unichem: ChEMBL;PDBe (Protein Data Bank Europe);KEGG (Kyoto Encyclopedia of Genes and Genomes) Ligand;ChEBI (Chemical Entities of Biological Interest).;ZINC;eMolecules;IBM strategic IP insight platform and the... (truncated)
Molecule keywords
DOI
13C Spectrum
10037982 Rating: 10
Type13C
Measurement conditions
Temperature [K]Unreported
SolventUnreported
Field Strength [MHz]Unreported
Assignment MethodUnreported
Literature S. Berger; S. Braun; H.-O. Kalinowski: 13-C-NMR-Spektroskopie, New York: Thieme Verlag 1984.
Additional comments283.MOL; Multiplicities generated automatically from H count
Additional information
Spectrum categories



Spectral Data   Additional Data   Download  
Type: 13C 150.0
Atom
No. ⇓
Mult.(coupling const.)
Meas.
Shift
expt-0
expt-1
ocmainz inhouse-2
1 D 109.534 109.4109.5
2 S 153.238 153.2153.3
3 D 117.729 117.6117.7
4 D 129.900 129.8129.8
4a S 128.945 128.5128.9
5 D 127.789 127.7127.7
6 D 123.676 123.5123.6
7 D 126.571 126.4125.5
8 D 126.393 126.3126.3
8a S 134.557 134.5134.6





Spectral Data   Additional Data   Download  
Type: 13C Unreported
Atom
No. ⇓
Mult.(coupling const.)
Meas.
Shift
expt-0
expt-1
Chemikalienlager Uni Mainz
1 S 153.3 153.2153.238
2 D 117.7 117.6117.729
3 D 129.8 129.8129.9
4 S 128.9 128.5128.945
5 S 134.6 134.5134.557
6 D 109.5 109.4109.534
7 D 126.3 126.3126.393
8 D 125.5 126.4126.571
9 D 123.6 123.5123.676
10 D 127.7 127.7127.789





Spectral Data   Additional Data   Download  
Type: 1H Unreported
Atom
No. ⇓
Mult.(coupling const.)
Meas.
Shift
2-H 7.089
3-H 7.740
6-H 7.122
7-H 7.655
8-H 7.417
9-H 7.321
10-H 7.750
11-H 5.190 (H 12)


 
     


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