MassBank Record: JP001971



 2,2,7,7-TETRAMETHYL-4-(TRIMETHYLSTANNYLMETHYL)CYCLOHEPT-4-ENONE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP001971
RECORD_TITLE: 2,2,7,7-TETRAMETHYL-4-(TRIMETHYLSTANNYLMETHYL)CYCLOHEPT-4-ENONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: 2,2,7,7-TETRAMETHYL-4-(TRIMETHYLSTANNYLMETHYL)CYCLOHEPT-4-ENONE CH$COMPOUND_CLASS: N/A CH$FORMULA: C15H28OSn CH$EXACT_MASS: 344.11621 CH$SMILES: O=C(C(C)(C)1)C(C)(C)CC(=CC1)C[Sn](C)(C)C CH$IUPAC: InChI=1S/C12H19O.3CH3.Sn/c1-9-6-7-11(2,3)10(13)12(4,5)8-9;;;;/h6H,1,7-8H2,2-5H3;3*1H3;
AC$INSTRUMENT: JEOL JMS-D-3000 AC$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$SPLASH: splash10-03xr-1902000000-1bd1d8db3973c830c8fb PK$NUM_PEAK: 27 PK$PEAK: m/z int. rel.int. 41 11.43 114 55 6.04 60 67 6.93 69 79 9.83 98 93 6.01 60 95 4.58 46 107 8.08 81 133 5.04 50 135 8.41 84 150 5.24 52 161 45.45 455 162 25.57 256 163 67.07 671 164 27.94 279 165 99.99 999 167 13.84 138 169 18.21 182 325 6.67 67 326 4.15 42 327 11.11 111 328 5.88 59 329 16.3 163 340 9.66 97 341 6.45 65 342 16.5 165 343 8.69 87 344 21.94 219 //