MassBank Record: JP002452



 (4S,5S)-2-(2-CHLOROETHYL)-4,5-BIS(METHOXYMETHYL)-1,3-DIOXOLANE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP002452
RECORD_TITLE: (4S,5S)-2-(2-CHLOROETHYL)-4,5-BIS(METHOXYMETHYL)-1,3-DIOXOLANE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: ITO S, DEPT. OF CHEM., TOHOKU UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: (4S,5S)-2-(2-CHLOROETHYL)-4,5-BIS(METHOXYMETHYL)-1,3-DIOXOLANE CH$COMPOUND_CLASS: N/A CH$FORMULA: C9H17ClO4 CH$EXACT_MASS: 224.08154 CH$SMILES: COCC([H])(O1)C([H])(COC)OC(CCCl)1 CH$IUPAC: InChI=1S/C9H17ClO4/c1-11-5-7-8(6-12-2)14-9(13-7)3-4-10/h7-9H,3-6H2,1-2H3/t7-,8-/m0/s1
AC$INSTRUMENT: HITACHI M-52 AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 25 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0cdu-9500000000-0cd1200f568bf7d8981a PK$NUM_PEAK: 53 PK$PEAK: m/z int. rel.int. 38 1.3 13 39 3.3 33 40 1.8 18 41 0.8 8 42 2 20 43 15.5 155 44 3.6 36 45 3.18 32 53 2.9 29 54 2 20 55 24.5 245 56 1 10 57 7.3 73 58 20.9 209 59 57.3 573 60 0.27 3 67 1.8 18 68 3.3 33 69 9.4 94 70 0.65 7 71 30 300 72 6.5 65 73 4.4 44 75 0.65 7 81 7.4 74 83 14.5 145 84 20.9 209 85 3.09 31 86 3.6 36 87 99.99 999 88 2.9 29 95 0.2 2 99 2.5 25 100 3.6 36 101 2.7 27 102 0.18 2 103 1.8 18 107 4.4 44 109 2.2 22 111 0.24 2 113 1.8 18 115 82.7 827 116 6.4 64 121 0.29 3 128 2.5 25 129 5.8 58 143 46.4 464 144 0.45 5 161 56.4 564 162 3.1 31 179 6.4 64 181 0.25 3 187 2.7 27 //