MassBank Record: JP002977



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

ACCESSION: JP002977
RECORD_TITLE: 3,4,6-TRI-O-ACETYL-D-GLUCAL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SASAKI S, TOYOHASHI UNIV. OF TECH.
LICENSE: CC BY-NC-SA

CH$NAME: 3,4,6-TRI-O-ACETYL-D-GLUCAL CH$COMPOUND_CLASS: N/A CH$FORMULA: C12H16O7 CH$EXACT_MASS: 272.08960 CH$SMILES: CC(=O)OCC(O1)C(OC(C)=O)C(C=C1)OC(C)=O CH$IUPAC: InChI=1S/C12H16O7/c1-7(13)17-6-11-12(19-9(3)15)10(4-5-16-11)18-8(2)14/h4-5,10-12H,6H2,1-3H3/t10-,11-,12+/m1/s1
AC$INSTRUMENT: Unknown AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-03ds-8900000000-ffd5d4564ea9f2d7c115 PK$NUM_PEAK: 21 PK$PEAK: m/z int. rel.int. 54 6 60 60 32 320 68 10 100 69 0.8 8 73 33 330 80 8 80 81 40 400 85 0.6 6 86 27 270 97 99 990 102 1 10 110 99.99 999 127 5 50 128 22 220 139 90 900 144 0.1 1 145 7 70 152 36 360 170 10 100 199 0.2 2 229 3 30 //