MassBank Record: JP002075



 2-(4-METHOXYPHENYL)ETHYL 2,3,4,6-TETRA-O-ACETYL-ALPHA-(D)-GLUCOPYRANOSIDE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP002075
RECORD_TITLE: 2-(4-METHOXYPHENYL)ETHYL 2,3,4,6-TETRA-O-ACETYL-ALPHA-(D)-GLUCOPYRANOSIDE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: ENDO K, PHARMACEUTICAL INST., TOHOKU UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: 2-(4-METHOXYPHENYL)ETHYL 2,3,4,6-TETRA-O-ACETYL-ALPHA-(D)-GLUCOPYRANOSIDE CH$COMPOUND_CLASS: N/A CH$FORMULA: C23H30O11 CH$EXACT_MASS: 482.17881 CH$SMILES: COc(c2)ccc(c2)CCOC(O1)C(OC(C)=O)C(OC(C)=O)C(OC(C)=O)C(COC(C)=O)1 CH$IUPAC: InChI=1S/C23H30O11/c1-13(24)30-12-19-20(31-14(2)25)21(32-15(3)26)22(33-16(4)27)23(34-19)29-11-10-17-6-8-18(28-5)9-7-17/h6-9,19-23H,10-12H2,1-5H3
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$SPLASH: splash10-001r-1900000000-2ca3aa3f0d9da8240416 PK$NUM_PEAK: 64 PK$PEAK: m/z int. rel.int. 41 0.6 6 43 35.2 352 44 0.8 8 55 0.06 1 56 0.6 6 57 1.7 17 61 0.6 6 69 0.15 2 70 1.9 19 71 1.5 15 73 0.8 8 77 0.08 1 79 1 10 81 4.2 42 83 0.8 8 85 0.1 1 91 1.1 11 97 2.5 25 98 2.9 29 99 0.11 1 102 1.3 13 103 3.4 34 105 3.8 38 108 0.4 4 109 15.2 152 110 1.3 13 112 1.3 13 113 0.06 1 115 4 40 116 0.8 8 119 0.6 6 120 0.13 1 121 10.3 103 122 1.1 11 126 1 10 127 0.59 6 128 0.6 6 134 99.99 999 135 75.1 751 136 0.69 7 137 0.6 6 139 1.7 17 140 1.1 11 144 0.06 1 145 2.3 23 149 5 50 150 0.6 6 157 0.23 2 158 0.6 6 163 0.6 6 167 2.1 21 168 0.08 1 169 17.1 171 170 1.5 15 171 0.6 6 187 0.08 1 200 0.8 8 211 1 10 229 0.8 8 280 0.06 1 331 2.7 27 332 0.6 6 482 6.1 61 483 1.5 15 //