MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008079
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008079
RECORD_TITLE: CARBITOL; EI-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$NAME: CARBITOL
CH$NAME: 2-(2-ETHOXYETHOXY)ETHANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H14O3
CH$EXACT_MASS: 134.09429
CH$SMILES: CCOCCOCCO
CH$IUPAC: InChI=1S/C6H14O3/c1-2-8-5-6-9-4-3-7/h7H,2-6H2,1H3
CH$LINK: INCHIKEY
XXJWXESWEXIICW-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID2021941
AC$INSTRUMENT: HITACHI RMU-6M
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: splash10-006t-9000000000-b49c9922c7da1f2f7486
PK$NUM_PEAK: 24
PK$PEAK: m/z int. rel.int.
27 1.32 13
28 2.65 27
29 8.18 82
31 30.33 303
33 1.93 19
41 2.05 21
43 6.26 63
44 5.54 55
45 99.99 999
46 2.77 28
47 1.44 14
59 48.5 485
60 13.24 132
61 2.65 27
62 2.41 24
72 43.56 436
73 18.17 182
74 1.2 12
75 8.42 84
89 1.68 17
101 2.05 21
103 5.17 52
104 7.46 75
116 0.96 10
//