MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008263
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008263
RECORD_TITLE: 5-AMINOISOXAZOLE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: UBE SCIENTIFIC ANALYSIS LABORATORY
LICENSE: CC BY-NC-SA
CH$NAME: 5-AMINOISOXAZOLE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C3H4N2O
CH$EXACT_MASS: 84.03236
CH$SMILES: Nc(c1)onc1
CH$IUPAC: InChI=1S/C3H4N2O/c4-3-1-2-5-6-3/h1-2H,4H2
CH$LINK: COMPTOX
DTXSID2074532
CH$LINK: INCHIKEY
IAXWZYXUKABJAN-UHFFFAOYSA-N
CH$LINK: PUBCHEM
CID:84591
AC$INSTRUMENT: HITACHI M-60
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: splash10-002f-9000000000-d4a7e727d67cada9f463
PK$NUM_PEAK: 30
PK$PEAK: m/z int. rel.int.
16 10.02 100
17 3.29 33
25 3.13 31
26 9.97 100
27 14.28 143
28 59.91 599
29 65.76 658
30 7.96 80
38 12.09 121
39 21.12 211
40 65.57 656
41 97.4 974
42 9 90
43 6.29 63
44 76.21 762
51 2.87 29
52 15.39 154
53 12.32 123
54 2.27 23
55 1.34 13
56 6.16 62
57 11.08 111
66 2.15 22
67 10.68 107
68 48.16 482
69 1.42 14
70 2.82 28
84 99.99 999
85 15.39 154
86 3.48 35
//