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MassBank Record: JP002465

(3S,6R)-6-(TERT-BUTYLDIMETHYLSILOXY)-3-METHYLNONEN-8-YNE; EI-B; MS

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: JP002465
RECORD_TITLE: (3S,6R)-6-(TERT-BUTYLDIMETHYLSILOXY)-3-METHYLNONEN-8-YNE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: ITO S, DEPT. OF CHEM., TOHOKU UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: (3S,6R)-6-(TERT-BUTYLDIMETHYLSILOXY)-3-METHYLNONEN-8-YNE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C16H30OSi
CH$EXACT_MASS: 266.20659
CH$SMILES: C#CCC([H])(CCC([H])(C)C=C)O[Si](C)(C)C(C)(C)C
CH$IUPAC: InChI=1S/C16H30OSi/c1-9-11-15(13-12-14(3)10-2)17-18(7,8)16(4,5)6/h1,10,14-15H,2,11-13H2,3-8H3/t14-,15+/m1/s1
CH$LINK: INCHIKEY HQRSOAULAMQNDH-CABCVRRESA-N

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 13.5 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-00kb-9510000000-d59a88cbf72db0d45a38
PK$NUM_PEAK: 28
PK$PEAK: m/z int. rel.int.
  56 5.6 56
  58 4.6 46
  75 30.8 308
  76 0.13 1
  77 6.4 64
  92 1 10
  93 2.5 25
  95 99.99 999
  96 9.2 92
  101 1.6 16
  105 1.1 11
  115 0.76 8
  133 25.6 256
  134 1.3 13
  149 1.6 16
  153 0.35 4
  165 1.2 12
  169 52 520
  170 2.6 26
  171 0.16 2
  183 1.2 12
  191 3.9 39
  209 27.6 276
  210 0.16 2
  211 1.5 15
  212 1.1 11
  227 3.5 35
  251 0.5 5
//

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