MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007375
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007375
RECORD_TITLE: ACETAL; 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$NAME: ACETAL
CH$NAME: 1,1-DIETHOXYETHANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H14O2
CH$EXACT_MASS: 118.09938
CH$SMILES: CCOC(C)OCC
CH$IUPAC: InChI=1S/C6H14O2/c1-4-7-6(3)8-5-2/h6H,4-5H2,1-3H3
CH$LINK: CAS
105-57-7
CH$LINK: INCHIKEY
DHKHKXVYLBGOIT-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID6030607
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$SPLASH: splash10-006t-9000000000-3b353ea9f033af3d7ad3
PK$NUM_PEAK: 18
PK$PEAK: m/z int. rel.int.
15 3.3 33
26 1.27 13
27 9.08 91
28 2.18 22
29 12.04 120
31 3.5 35
43 11.76 118
44 4.77 48
45 99.99 999
46 2.54 25
47 17.13 171
61 3.41 34
72 1.31 13
73 61.6 616
74 2.95 30
75 5.9 59
103 18.31 183
104 1.18 12
//