MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP009055
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009055
RECORD_TITLE: ISOPENTYLAMINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA
CH$NAME: ISOPENTYLAMINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C5H13N
CH$EXACT_MASS: 87.10480
CH$SMILES: NCCC(C)C
CH$IUPAC: InChI=1S/C5H13N/c1-5(2)3-4-6/h5H,3-4,6H2,1-2H3
CH$LINK: CAS
107-85-7
CH$LINK: INCHIKEY
BMFVGAAISNGQNM-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID7059355
AC$INSTRUMENT: HITACHI M-80B
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-001i-9000000000-a38f41cef45a48b3b69d
PK$NUM_PEAK: 12
PK$PEAK: m/z int. rel.int.
30 99.99 999
31 2.16 22
39 5.83 58
41 6.55 66
42 4.22 42
43 3.53 35
44 4.46 45
45 1.99 20
55 3.4 34
58 1.21 12
70 6.64 66
87 4.42 44
//