MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP011407
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011407
RECORD_TITLE: 3-ETHENYL-2,5-DIPROPYLTETRAHYDROFURAN; CI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HISAHIRO HAGIWARA, INSTITUTE FOR CHEMICAL REACTION SCIENCE TOHOKU UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: 3-ETHENYL-2,5-DIPROPYLTETRAHYDROFURAN
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H22O
CH$EXACT_MASS: 182.16707
CH$SMILES: CCCC(C1)OC(CCC)C(C=C)1
CH$IUPAC: InChI=1S/C12H22O/c1-4-7-11-9-10(6-3)12(13-11)8-5-2/h6,10-12H,3-5,7-9H2,1-2H3
CH$LINK: INCHIKEY
RGUDGBPPEKIZQX-UHFFFAOYSA-N
AC$INSTRUMENT: JEOL JMS-DX-300
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$MASS_SPECTROMETRY: REAGENT_GAS METHANE
PK$SPLASH: splash10-090s-5900000000-f82b4adede6c63dc6093
PK$NUM_PEAK: 40
PK$PEAK: m/z int. rel.int.
43 4.9 49
54 5.3 53
55 23.4 234
57 7.9 79
67 9.6 96
68 5.3 53
69 42.9 429
70 2.9 29
71 28.8 288
72 2.1 21
73 17.2 172
81 19.1 191
82 4.8 48
83 18.6 186
95 62.9 629
96 6.1 61
97 16 160
99 2.5 25
101 10.5 105
107 2.1 21
109 38.6 386
110 20.5 205
111 99.99 999
112 11 110
113 6.9 69
115 8.1 81
121 2.5 25
123 14.2 142
127 2.7 27
137 2.7 27
139 33 330
140 4 40
163 5 50
165 69.6 696
166 11.6 116
181 13.4 134
182 2 20
183 72.8 728
184 11.3 113
185 2.6 26
//