MassBank Record: JP001486



 N-ACETYL-GLYCYL-ALANYL-ALANYL-GLYCINE METHYL ESTER; FD-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP001486
RECORD_TITLE: N-ACETYL-GLYCYL-ALANYL-ALANYL-GLYCINE METHYL ESTER; FD-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: N-ACETYL-GLYCYL-ALANYL-ALANYL-GLYCINE METHYL ESTER CH$COMPOUND_CLASS: N/A CH$FORMULA: C13H22N4O6 CH$EXACT_MASS: 330.15393 CH$SMILES: COC(=O)CNC(=O)C([H])(C)NC(=O)C([H])(C)NC(=O)CNC(C)=O CH$IUPAC: InChI=1S/C13H22N4O6/c1-7(12(21)15-6-11(20)23-4)17-13(22)8(2)16-10(19)5-14-9(3)18/h7-8H,5-6H2,1-4H3,(H,14,18)(H,15,21)(H,16,19)(H,17,22)/t7-,8+/m0/s1
AC$INSTRUMENT: Unknown AC$INSTRUMENT_TYPE: FD-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-001i-0119002000-536391ec61f1150c48aa PK$NUM_PEAK: 20 PK$PEAK: m/z int. rel.int. 116 7.99 80 143 21.03 210 157 15.02 150 187 16.28 163 211 5.92 59 214 34.18 342 215 12.94 129 239 3.97 40 330 86.51 865 331 99.99 999 353 55.84 558 354 23.46 235 368 16.97 170 625 3.62 36 661 4.37 44 681 17.23 172 682 4.2 42 683 32.4 324 684 23.43 234 699 7.31 73 //