MassBank Record: MSBNK-EPA-ENTACT_AGILENT000920

Benzenecarboximidamide; ESI-QTOF; MS2; CE: 20; [M+H]+

---

ACCESSION: MSBNK-EPA-ENTACT_AGILENT000920
RECORD_TITLE: Benzenecarboximidamide; ESI-QTOF; MS2; CE: 20; [M+H]+
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

---

CH$NAME: Benzenecarboximidamide
CH$NAME: DTXSID9044401
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₇H₈N₂
CH$EXACT_MASS: 120.06874827
CH$SMILES: NC(=N)C1C=CC=CC=1
CH$IUPAC: InChI=1S/C7H8N2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H3,8,9)
CH$LINK: CAS 618-39-3
CH$LINK: INCHIKEY PXXJHWLDUBFPOL-UHFFFAOYSA-N

---

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 20

---

MS$FOCUSED_ION: PRECURSOR_M/Z 121.0760247217
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

---

PK$SPLASH: splash10-0udi-1900000000-c62ad412474c92e3580a
PK$NUM_PEAK: 4
PK$PEAK: m/z int. rel.int.
  51.022927 1.247977 12
  77.038577 17.484542 174
  104.049476 100 999
  121.076025 9.408751 93
//