MassBank Record: NGA02272



 1-Hydroxy-2-methoxyanthraquinone; LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+ 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: NGA02272
RECORD_TITLE: 1-Hydroxy-2-methoxyanthraquinone; LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
DATE: 2018.04.04
AUTHORS: Nogawa TCSRS, RIKEN, Okano ACSRS, RIKEN, CSRS, RIKEN
LICENSE: BY-CC
COMMENT: Origin: Plant, Organic chemicals, Polycyclic compounds, Anthracenes

CH$NAME: 1-Hydroxy-2-methoxyanthraquinone CH$COMPOUND_CLASS: Polycyclic aromatic natural products CH$FORMULA: C15H10O4 CH$EXACT_MASS: 254.24455000000003 CH$SMILES: COc1ccc2c(c1O)C(=O)c1ccccc1C2=O CH$IUPAC: InChI=1S/C15H10O4/c1-19-11-7-6-10-12(15(11)18)14(17)9-5-3-2-4-8(9)13(10)16/h2-7,18H,1H3 CH$LINK: CAS 6003-11-8 CH$LINK: PUBCHEM CID:72353 CH$LINK: INCHIKEY BYQWRZGQEZAOPQ-UHFFFAOYSA-N
AC$INSTRUMENT: Agilent 6410 Triple Quadrupole LC/MS system AC$INSTRUMENT_TYPE: LC-ESI-QQQ AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-0a4i-0090000000-25955a9f7806ce8b46db PK$NUM_PEAK: 16 PK$PEAK: m/z int. rel.int. 254.2 0.23 0 254.3 0.9 0 254.4 4.16 4 254.5 12.49 12 254.6 26.23 26 254.7 43.05 43 254.8 60.73 60 254.9 77.95 77 255.0 92.15 92 255.1 100.0 99 255.2 99.65 99 255.3 89.34 89 255.4 67.06 66 255.5 36.58 36 255.6 9.93 9 255.7 0.0 0 //