ACCESSION: MSBNK-RIKEN_NPDepo-CB000031
RECORD_TITLE: piperine; LC-ESI-QQQ; MS; [M+H]+
DATE: 2018.04.04
AUTHORS: Nogawa T, Okano A, CSRS, RIKEN
LICENSE: CC BY
COMMENT: Origin: Plant
COMMENT: SubCategory_DNP: Alkaloids derived from lysine, Piperidine alkaloids
CH$NAME: piperine
CH$COMPOUND_CLASS: Alkaloids
CH$FORMULA: C17H19NO3
CH$EXACT_MASS: 285.3459
CH$SMILES: O=C(/C=C/C=C/c1ccc2c(c1)OCO2)N1CCCCC1
CH$IUPAC: InChI=1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2+,7-3+
CH$LINK: CAS
495-91-0
CH$LINK: CHEMSPIDER
553590
CH$LINK: INCHIKEY
MXXWOMGUGJBKIW-YPCIICBESA-N
CH$LINK: COMPTOX
DTXSID3021805
CH$LINK: PUBCHEM
CID:638024
AC$INSTRUMENT: ABSciex API3200 LC/MS system
AC$INSTRUMENT_TYPE: LC-ESI-QQQ
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-000i-0290000000-c7c46f7bdb965a4a930c
PK$NUM_PEAK: 182
PK$PEAK: m/z int. rel.int.
111.5000 463199.7813 36
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134.3000 1435102.5000 113
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572.3000 409140.3750 31
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