MassBank Record: JP003680



 1,2,3,4-TETRAMETHOXYBUTANE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP003680
RECORD_TITLE: 1,2,3,4-TETRAMETHOXYBUTANE; EI-B; MS
DATE: 2016.01.19 (2008.10.21, 2011.05.06)
AUTHORS: SASAKI STOYOHASHI UNIV. OF TECH., TOYOHASHI UNIV. OF TECH.
LICENSE: CC BY-NC-SA

CH$NAME: 1,2,3,4-TETRAMETHOXYBUTANE CH$COMPOUND_CLASS: N/A CH$FORMULA: C8H18O4 CH$EXACT_MASS: 178.12051 CH$SMILES: COCC(OC)C(OC)COC CH$IUPAC: InChI=1S/C8H18O4/c1-9-5-7(11-3)8(12-4)6-10-2/h7-8H,5-6H2,1-4H3 CH$LINK: INCHIKEY UOTINMFZLVZNEW-UHFFFAOYSA-N CH$LINK: COMPTOX DTXSID50337398
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: splash10-052b-9000000000-01f2062cef7485d8e4ba PK$NUM_PEAK: 37 PK$PEAK: m/z int. rel.int. 39 1.9 19 41 6.8 68 42 1.6 16 43 0.81 8 44 1.6 16 45 99.99 999 46 2.2 22 47 0.29 3 53 0.7 7 55 1.4 14 56 1 10 57 0.16 2 58 28.1 281 59 35.4 354 60 1.7 17 69 0.08 1 71 12.4 124 72 2.5 25 73 9.4 94 74 0.18 2 75 42.7 427 76 1.4 14 85 1 10 87 0.15 2 88 27.7 277 89 21.2 212 90 1.1 11 101 3.96 40 102 3.2 32 103 4.8 48 104 0.8 8 115 1.1 11 119 1.4 14 120 0.09 1 133 8.2 82 134 0.5 5 146 0.21 2 //

MassBank | Copyright Line
Copyright © since 2006 MassBank Project
Copyright © since 2011 NORMAN Association
Copyright © since 2017 MassBank Consortium
Responsible: Dr. Tobias Schulze (tobias.schulze@ufz.de)