Systematic / IUPAC Name: 4-(3,4-Dihydroxyphenyl)-6,7-dihydroxy-2-naphthoic acid
ID: Reference7610
Other Names:
KS IV;
3-Carboxy-6,7-dihydroxy-1-(3',4'-dihydroxy)phenylnaphthalene;
4-(3,4-Dihydroxyphenyl)-6,7-dihydroxynaphthalene-2-carboxylic acid;
2-Naphthalenecarboxylic acid, 4-(3,4-dihydroxyphenyl)-6,7-dihydroxy-
Formula: C17H12O6
4-(3,4-Dihydroxyphenyl)-6,7-dihydroxy-2-naphthoic acid mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Orbitrap Fusion Lumos with ETD LBP FAIMS |
No. of Spectral Trees | 3 |
No. of Spectra | 2082 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 3/22/2018 6:14:57 AM |
InChI | InChI=1S/C17H12O6/c18-13-2-1-8(5-14(13)19)11-4-10(17(22)23)3-9-6-15(20)16(21)7-12(9)11/h1-7,18-21H,(H,22,23) |
InChI Key | ZSKDVJYWOHBGNI-UHFFFAOYSA-N |
Canonical SMILES | C1=CC(=C(C=C1C2=C3C=C(C(=CC3=CC(=C2)C(=O)O)O)O)O)O |
CAS | |
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Other Names |
KS IV; 3-Carboxy-6,7-dihydroxy-1-(3',4'-dihydroxy)phenylnaphthalene; 4-(3,4-Dihydroxyphenyl)-6,7-dihydroxynaphthalene-2-carboxylic acid; 2-Naphthalenecarboxylic acid, 4-(3,4-dihydroxyphenyl)-6,7-dihydroxy- |