MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP003822
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003822
RECORD_TITLE: METHYPRYLON; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SASAKI S, TOYOHASHI UNIV. OF TECH.
LICENSE: CC BY-NC-SA
CH$NAME: METHYPRYLON
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H17NO2
CH$EXACT_MASS: 183.12593
CH$SMILES: CCC(CC)(C(=O)1)C(=O)C(C)CN1
CH$IUPAC: InChI=1S/C10H17NO2/c1-4-10(5-2)8(12)7(3)6-11-9(10)13/h7H,4-6H2,1-3H3,(H,11,13)
CH$LINK: INCHIKEY
SIDLZWOQUZRBRU-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID7023306
AC$INSTRUMENT: Unknown
AC$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$SPLASH: splash10-0a4l-6900000000-385d8cb9bf60082827ac
PK$NUM_PEAK: 26
PK$PEAK: m/z int. rel.int.
51 0.9 9
52 0.9 9
53 6.9 69
54 0.29 3
55 33.9 339
56 8.9 89
57 7.9 79
58 0.39 4
83 53.9 539
84 5.9 59
85 5.9 59
86 0.49 5
95 0.9 9
96 0.9 9
97 7.9 79
98 4.69 47
99 4.9 49
140 76.9 769
141 7.9 79
142 0.09 1
154 7.9 79
155 99.99 999
156 2.4 24
168 0.74 7
169 0.9 9
183 2.9 29
//