ACCESSION: MSBNK-EPA-ENTACT_AGILENT000249
RECORD_TITLE: 2-Amino-6-methoxybenzothiazole; ESI-QTOF; MS2; CE: 10; [M+H]+
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 2-Amino-6-methoxybenzothiazole
CH$NAME: DTXSID9024485
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₈N₂OS
CH$EXACT_MASS: 180.0357336223
CH$SMILES: COC1=CC2SC(N)=NC=2C=C1
CH$IUPAC: InChI=1S/C8H8N2OS/c1-11-5-2-3-6-7(4-5)12-8(9)10-6/h2-4H,1H3,(H2,9,10)
CH$LINK: CAS 1747-60-0
CH$LINK: INCHIKEY KZHGPDSVHSDCMX-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:15630

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

MS$FOCUSED_ION: PRECURSOR_M/Z 181.043010074
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-001i-0900000000-f75e03bfc5dbc89ea647
PK$NUM_PEAK: 3
PK$PEAK: m/z int. rel.int.
  138.02462 1.023273 10
  166.019535 6.76671 67
  181.04301 100.000003 999
//