MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP003651
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003651
RECORD_TITLE: 1,2-DI-TERT-BUTYL-3-PIVALOYLCYCLOPROPENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SASAKI S, TOYOHASHI UNIV. OF TECH.
LICENSE: CC BY-NC-SA
CH$NAME: 1,2-DI-TERT-BUTYL-3-PIVALOYLCYCLOPROPENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C16H28O
CH$EXACT_MASS: 236.21402
CH$SMILES: CC(C)(C)C(=O)C(C(C(C)(C)C)=1)C(C(C)(C)C)1
CH$IUPAC: InChI=1S/C16H28O/c1-14(2,3)11-10(12(11)15(4,5)6)13(17)16(7,8)9/h10H,1-9H3
CH$LINK: INCHIKEY
SBJOZYNYYAHDOF-UHFFFAOYSA-N
AC$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$SPLASH: splash10-0udi-2910000000-dba8a6d313f077b236c5
PK$NUM_PEAK: 11
PK$PEAK: m/z int. rel.int.
41 14 140
43 5 50
55 5 50
57 3.1 31
67 6 60
95 7 70
108 9 90
151 99.99 999
152 12 120
221 15 150
236 0.6 6
//
system version 2.2.8-SNAPSHOT