MassBank Record: JP002074



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

ACCESSION: JP002074
RECORD_TITLE: 2-(4-METHOXYPHENYL)ETHYL 2,3,4,6-TETRA-O-ACETYL-BETA-(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$NAME: 2-(4-METHOXYPHENYL)ETHYL 2,3,4,6-TETRA-O-ACETYL-BETA-(D)-GLUCOPYRANOSIDE CH$NAME: METHYLSALIDROSIDE TETRAACETATE 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: splash10-0019-1900000000-9088245655f3b29d6ca2 PK$NUM_PEAK: 63 PK$PEAK: m/z int. rel.int. 41 0.5 5 43 21.3 213 44 0.7 7 55 0.05 1 57 0.8 8 61 0.5 5 69 1.7 17 70 0.13 1 71 0.7 7 73 0.5 5 77 0.8 8 79 0.1 1 80 0.5 5 81 3.3 33 82 0.5 5 83 0.05 1 85 0.7 7 91 1 10 92 0.5 5 98 0.18 2 99 1.3 13 102 1.3 13 103 3 30 104 0.05 1 105 4.7 47 106 0.7 7 108 3.7 37 109 1.05 11 110 1.3 13 111 0.5 5 112 1.5 15 115 0.22 2 119 0.5 5 120 1.2 12 121 12 120 122 0.1 1 127 4.7 47 128 0.7 7 134 95.5 955 135 99.99 999 136 9.5 95 137 0.8 8 139 1.5 15 140 0.07 1 141 1.3 13 144 0.5 5 145 1.8 18 149 0.05 1 152 0.3 3 157 1.2 12 163 0.5 5 169 1.21 12 170 1.3 13 187 0.7 7 211 0.7 7 229 0.08 1 271 0.7 7 331 3.8 38 332 0.7 7 482 0.83 8 483 2.3 23 484 0.5 5 97 1.8 18 //