MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP004472
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004472
RECORD_TITLE: 6-METHYL-4-OXO-1,6,7,8,9,9A-HEXAHYDRO-4H-PYRIDO(1,2-A)PYRIMIDINE-3-CARBOXAMIDE; 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$NAME: 6-METHYL-4-OXO-1,6,7,8,9,9A-HEXAHYDRO-4H-PYRIDO(1,2-A)PYRIMIDINE-3-CARBOXAMIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H15N3O2
CH$EXACT_MASS: 209.11643
CH$SMILES: NC(=O)C(=C1)C(=O)N(C(C)2)C(CCC2)N1
CH$IUPAC: InChI=1S/C10H15N3O2/c1-6-3-2-4-8-12-5-7(9(11)14)10(15)13(6)8/h5-6,8,12H,2-4H2,1H3,(H2,11,14)
CH$LINK: INCHIKEY
UWAODFKLWXEVDH-UHFFFAOYSA-N
AC$INSTRUMENT: MX-1303
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 50 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0abd-4930000000-af958919ae73fcbd7033
PK$NUM_PEAK: 39
PK$PEAK: m/z int. rel.int.
67 6 60
68 6 60
69 40 400
70 1.4 14
82 16 160
83 4 40
94 6 60
95 1.1 11
96 6 60
97 55 550
98 13 130
108 0.7 7
109 3 30
113 14 140
122 5 50
123 99.99 999
124 8 80
135 6 60
136 8 80
137 1.3 13
138 4 40
139 9 90
140 90 900
152 0.9 9
162 4 40
164 9 90
165 6 60
167 0.6 6
175 4 40
177 15 150
180 6 60
181 0.4 4
190 9 90
191 12 120
192 12 120
194 2.8 28
208 47 470
209 71 710
210 10 100
//