MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP006042
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006042
RECORD_TITLE: TRIPROPYLENE GLYCOL MONOMETHYL ETHER; 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$NAME: TRIPROPYLENE GLYCOL MONOMETHYL ETHER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H22O4
CH$EXACT_MASS: 206.15181
CH$SMILES: OCCCOCCCOCCCOC
CH$IUPAC: InChI=1S/C10H22O4/c1-12-6-3-8-14-10-4-9-13-7-2-5-11/h11H,2-10H2,1H3
CH$LINK: INCHIKEY
GRTBNOKQBKPUGM-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID00157003
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$SPLASH: splash10-0avi-9600000000-28d7830d3bb40d2862ad
PK$NUM_PEAK: 26
PK$PEAK: m/z int. rel.int.
31 5.33 53
41 7.11 71
42 1.08 11
43 1.89 19
45 13.27 133
47 1.53 15
57 5.29 53
58 4.49 45
59 99.99 999
60 5.66 57
72 12.9 129
73 73.74 737
74 3.48 35
85 1.36 14
87 1.85 19
99 2.58 26
103 38.25 383
104 2.57 26
117 74.69 747
118 5.28 53
130 3.47 35
132 5.41 54
161 31.78 318
162 3.18 32
206 0.86 9
207 0.09 1
//
system version 2.2.8-SNAPSHOT