ACCESSION: MSBNK-EPA-ENTACT_AGILENT001523
RECORD_TITLE: 5-Phenyl-1H-tetrazole; ESI-QTOF; MS2; CE: 40; [M+H]+
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 5-Phenyl-1H-tetrazole
CH$NAME: DTXSID6044858
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₇H₆N₄
CH$EXACT_MASS: 146.059246221
CH$SMILES: C1=CC=CC=C1C1NN=NN=1
CH$IUPAC: InChI=1S/C7H6N4/c1-2-4-6(5-3-1)7-8-10-11-9-7/h1-5H,(H,8,9,10,11)
CH$LINK: CAS 18039-42-4
CH$LINK: INCHIKEY MARUHZGHZWCEQU-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:87425

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 40

MS$FOCUSED_ION: PRECURSOR_M/Z 147.0665226727
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-004i-9100000000-5d10068b1c6f726e96ae
PK$NUM_PEAK: 7
PK$PEAK: m/z int. rel.int.
  39.022927 1.443538 14
  50.015101 1.556307 15
  51.022927 19.951234 199
  77.038577 99.999996 999
  89.038577 1.045701 10
  90.046402 1.941307 19
  104.049476 23.120235 230
//