MassBank Record: TY000045



 Corydaline; LC-ESI-ITTOF; MS; [M+H]+ 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: TY000045
RECORD_TITLE: Corydaline; LC-ESI-ITTOF; MS; [M+H]+
DATE: 2016.01.19 (Created 2008.10.10, modified 2011.05.06)
AUTHORS: Ken Tanaka
LICENSE: CC BY-SA

CH$NAME: Corydaline CH$NAME: 5,8,13,13a-Tetrahydro-2,3,9,10-tetramethoxy-13-methyl-6H-dibenzo[a,g]quinolizine CH$NAME: 2,3,9,10-Tetramethoxy-13-methylberbine CH$NAME: Corydalis A CH$NAME: 6H-Dibenzo[a,g]quinolizine, 5,8,13,13a-tetrahydro-2,3,9,10-tetramethoxy-13-methyl-, (13S,13aR)- CH$NAME: 13a beta-Berbine, 2,3,9,10-tetramethoxy-13alpha-methyl- CH$NAME: 6H-Dibenzo[a,g]quinolizine CH$NAME: 5,8,13,13a-tetrahydro-2,3,9,10-tetramethoxy-13-methyl-, (13S-trans)- CH$NAME: 7,8,13,13alpha-Tetrahydrocorydaline CH$NAME: NSC 406036 CH$NAME: d-Corydaline CH$NAME: Berbine, 2,3,9,10-tetramethoxy-13-methyl- CH$NAME: (13S,13aR)-2,3,9,10-tetramethoxy-13-methyl-5,8,13,13a-tetrahydro-6H-isoquino[3,2-a]isoquinoline CH$COMPOUND_CLASS: Natural Product; Alkaloid CH$FORMULA: C22H27NO4 CH$EXACT_MASS: 369.19401 CH$SMILES: COc(c4)c(OC)cc(c43)C([H])(N(CC3)1)C(C)c(c2)c(c(OC)c(OC)c2)C1 CH$IUPAC: InChI=1S/C22H27NO4/c1-13-15-6-7-18(24-2)22(27-5)17(15)12-23-9-8-14-10-19(25-3)20(26-4)11-16(14)21(13)23/h6-7,10-11,13,21H,8-9,12H2,1-5H3/t13-,21+/m0/s1 CH$LINK: CAS 518-69-4 CH$LINK: NIKKAJI J34.125H CH$LINK: PUBCHEM 101301
AC$INSTRUMENT: Shimadzu LC20A-IT-TOFMS AC$INSTRUMENT_TYPE: LC-ESI-ITTOF AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: CDL_TEMPERATURE 200 C AC$MASS_SPECTROMETRY: INTERFACE_VOLTAGE +4.50 kV AC$MASS_SPECTROMETRY: SCANNING_RANGE 100-2000 AC$CHROMATOGRAPHY: COLUMN_NAME Waters Atlantis T3 (2.1 x 150 mm, 5 um) AC$CHROMATOGRAPHY: COLUMN_TEMPERATURE 40 C AC$CHROMATOGRAPHY: FLOW_GRADIENT 10 % B to 100 % B/40 min AC$CHROMATOGRAPHY: FLOW_RATE 0.2 ml/min AC$CHROMATOGRAPHY: RETENTION_TIME 1518.901 AC$CHROMATOGRAPHY: SOLVENT (A)5 mM ammonium acetate, (B)CH3CN
MS$FOCUSED_ION: ION_TYPE [M+H]+
PK$SPLASH: splash10-00di-0009000000-462846c6224aed8ed6ac PK$NUM_PEAK: 3 PK$PEAK: m/z int. rel.int. 368.1850 31650157 108 370.2010 291606406 999 371.2037 71406331 245 //