MassBank Record: JP009006



 DI-TERT-BUTYL MALONATE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP009006
RECORD_TITLE: DI-TERT-BUTYL MALONATE; EI-B; MS
DATE: 2016.01.19 (2008.10.21, 2011.05.06)
AUTHORS: , SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA

CH$NAME: DI-TERT-BUTYL MALONATE CH$COMPOUND_CLASS: N/A CH$FORMULA: C11H20O4 CH$EXACT_MASS: 216.13616 CH$SMILES: O=C(CC(=O)OC(C)(C)C)OC(C)(C)C CH$IUPAC: InChI=1S/C11H20O4/c1-10(2,3)14-8(12)7-9(13)15-11(4,5)6/h7H2,1-6H3 CH$LINK: CAS 541-16-2 CH$LINK: INCHIKEY CLPHAYNBNTVRDI-UHFFFAOYSA-N
AC$INSTRUMENT: HITACHI M-80B AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0a4l-9000000000-1cf9c357da30947c55e2 PK$NUM_PEAK: 27 PK$PEAK: m/z int. rel.int. 27 13.97 140 29 12.12 121 31 1.44 14 37 2 20 38 4.94 49 39 36.59 366 41 80.61 806 42 9.17 92 43 12.4 124 44 11.16 112 45 1.67 17 50 3.76 38 51 3.06 31 53 3.72 37 54 1.18 12 55 12.28 123 56 37.05 371 57 99.99 999 58 5.02 50 59 26.95 270 60 1.43 14 69 1.07 11 87 1.25 13 105 10.62 106 115 1.67 17 145 6.92 69 161 1.06 11 //