MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007415
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007415
RECORD_TITLE: 2-(DIETHYLAMINO)ETHANOL; CI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: 2-(DIETHYLAMINO)ETHANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H15NO
CH$EXACT_MASS: 117.11536
CH$SMILES: OCCN(CC)CC
CH$IUPAC: InChI=1S/C6H15NO/c1-3-7(4-2)5-6-8/h8H,3-6H2,1-2H3
CH$LINK: CAS
100-37-8
CH$LINK: INCHIKEY
BFSVOASYOCHEOV-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID5021837
AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: CI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV
AC$MASS_SPECTROMETRY: REAGENT_GAS ISOBUTANE
PK$SPLASH: splash10-014i-0900000000-798a98f8899d79a39044
PK$NUM_PEAK: 15
PK$PEAK: m/z int. rel.int.
86 8.91 89
87 0.64 6
100 6.76 68
101 0.61 6
116 4.23 42
117 3.04 30
118 99.99 999
119 7.58 76
156 0.56 6
158 3.02 30
160 7.31 73
161 0.77 8
172 0.55 6
174 12.13 121
175 1.44 14
//