MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008898
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008898
RECORD_TITLE: TETRAHYDROPYRAN-2-METHANOL; 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$NAME: TETRAHYDROPYRAN-2-METHANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H12O2
CH$EXACT_MASS: 116.08373
CH$SMILES: OCC(C1)OCCC1
CH$IUPAC: InChI=1S/C6H12O2/c7-5-6-3-1-2-4-8-6/h6-7H,1-5H2
CH$LINK: INCHIKEY
ROTONRWJLXYJBD-UHFFFAOYSA-N
AC$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 70 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-002r-9000000000-f0198f34ec8d423a4645
PK$NUM_PEAK: 29
PK$PEAK: m/z int. rel.int.
15 2.9 29
26 2.7 27
27 20.1 201
28 1.09 11
29 37.2 372
30 1.5 15
31 24.3 243
32 0.35 4
38 1 10
39 13.4 134
40 2.5 25
41 5.49 55
42 3.2 32
43 27.7 277
44 3.4 34
45 0.18 2
51 1.3 13
53 3.1 31
54 1.2 12
55 1.5 15
56 5 50
57 26.8 268
58 1.5 15
59 0.1 1
60 1.5 15
84 5 50
85 99.99 999
86 0.59 6
116 0.6 6
//