MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP006287
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006287
RECORD_TITLE: ACETALDEHYDE DIMETHYL ACETAL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA
CH$NAME: ACETALDEHYDE DIMETHYL ACETAL
CH$NAME: 1,1-DIMETHOXYETHANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C4H10O2
CH$EXACT_MASS: 90.06808
CH$SMILES: COC(C)OC
CH$IUPAC: InChI=1S/C4H10O2/c1-4(5-2)6-3/h4H,1-3H3
CH$LINK: CAS
534-15-6
CH$LINK: INCHIKEY
SPEUIVXLLWOEMJ-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID7027178
AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-00pi-9000000000-f08d7649704a8ec91f92
PK$NUM_PEAK: 25
PK$PEAK: m/z int. rel.int.
14 36.49 365
15 88.95 890
16 7.28 73
17 0.69 7
18 0.87 9
25 0.78 8
26 20.12 201
28 11.81 118
29 99.99 999
30 57.74 577
31 57 570
32 1.02 10
33 1.36 14
39 1.35 14
41 3.14 31
42 11.28 113
43 38.68 387
44 1.6 16
45 2.62 26
47 6.8 68
58 1.26 13
59 30.17 302
60 2.15 22
75 8.03 80
89 0.31 3
//