MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007825
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007825
RECORD_TITLE: 5,7-DIMETHYLINDOLE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HASHIMOTO K, KYOTO COLLEGE OF PHARMACY
LICENSE: CC BY-NC-SA
CH$NAME: 5,7-DIMETHYLINDOLE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H11N
CH$EXACT_MASS: 145.08915
CH$SMILES: CC1=CC(=C2C(=C1)C=CN2)C
CH$IUPAC: InChI=1S/C10H11N/c1-7-5-8(2)10-9(6-7)3-4-11-10/h3-6,11H,1-2H3
CH$LINK: INCHIKEY
DVHNMQQXLMOZKB-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID20343385
AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-000w-2900000000-0f7473b9fdb751ff2184
PK$NUM_PEAK: 19
PK$PEAK: m/z int. rel.int.
27 1.16 12
28 1.01 10
38 3.11 31
39 12.32 123
51 11.42 114
58.5 8.12 81
63 7.42 74
65 10.32 103
77 7.12 71
89 4.11 41
91 6.22 62
103 3.51 35
115 12.32 123
117 7.62 76
130 63.07 631
131 6.82 68
144 73.08 731
145 99.99 999
146 10.92 109
//