MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP002942
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002942
RECORD_TITLE: 5-AMINO ISOXAZOLE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA
CH$NAME: 5-AMINO ISOXAZOLE
CH$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$LINK: INCHIKEY
IAXWZYXUKABJAN-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID2074532
AC$INSTRUMENT: Unknown
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-002f-9000000000-d3213552c48053142060
PK$NUM_PEAK: 32
PK$PEAK: m/z int. rel.int.
11 2.11 21
12 5.94 59
14 12.16 122
15 3.96 40
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
56 6.16 62
57 11.08 111
66 2.15 22
67 10.68 107
68 48.16 482
70 2.82 28
84 99.99 999
85 15.39 154
86 3.48 35
//