MassBank Record: MSBNK-AGILENT-AG000035

Imazapyr; ESI-QTOF; MS2; CE: 10; [M+H]+

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ACCESSION: MSBNK-AGILENT-AG000035
RECORD_TITLE: Imazapyr; ESI-QTOF; MS2; CE: 10; [M+H]+
DATE: 2023.02.17
AUTHORS: Rennie E, McEachran A, Agilent Technologies
LICENSE: CC BY

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CH$NAME: Imazapyr
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₃H₁₅N₃O₃
CH$EXACT_MASS: 261.11134
CH$SMILES: CC1(N=C(NC1=O)C1=NC=CC=C1C(O)=O)C(C)C
CH$IUPAC: InChI=1S/C13H15N3O3/c1-7(2)13(3)12(19)15-10(16-13)9-8(11(17)18)5-4-6-14-9/h4-7H,1-3H3,(H,17,18)(H,15,16,19)
CH$LINK: CAS 81334-34-1
CH$LINK: CHEMSPIDER 49445
CH$LINK: INCHIKEY CLQMBPJKHLGMQK-UHFFFAOYSA-N

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AC$INSTRUMENT: N/A
AC$INSTRUMENT_TYPE: ESI-QTOF
AC$MASS_SPECTROMETRY: MS_TYPE MS2
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 10

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MS$FOCUSED_ION: PRECURSOR_M/Z 262.1186178193
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+

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PK$SPLASH: splash10-03di-0090000000-a6c7feb52a557cc44cbc
PK$NUM_PEAK: 9
PK$PEAK: m/z int. rel.int.
  69.069877 1.191739 11
  86.096426 1.495504 14
  149.034554 1.399743 13
  202.061103 2.054068 20
  216.113139 1.066863 10
  217.097154 8.612695 86
  220.071668 7.571621 75
  234.123703 7.008477 70
  262.118618 100 999
//