MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP002386
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002386
RECORD_TITLE: N-(1-ADAMANTYL)-2-METHYLCYCLOHEXANIMINE; 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$NAME: N-(1-ADAMANTYL)-2-METHYLCYCLOHEXANIMINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C17H27N
CH$EXACT_MASS: 245.21435
CH$SMILES: CC(C4)C(CCC4)=NC(C3)(C1)CC([H])(C2)CC([H])(CC([H])23)1
CH$IUPAC: InChI=1S/C17H27N/c1-12-4-2-3-5-16(12)18-17-9-13-6-14(10-17)8-15(7-13)11-17/h12-15H,2-11H2,1H3/b18-16+/t12?,13-,14+,15-,17-
CH$LINK: INCHIKEY
HYDCFZQSWVGFFZ-OZRGJFLCSA-N
AC$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: splash10-000i-4920000000-63376b9222f794bed58a
PK$NUM_PEAK: 16
PK$PEAK: m/z int. rel.int.
53 3.17 32
55 7.21 72
67 9.17 92
69 2.51 25
77 4.9 49
79 15.62 156
81 5.21 52
91 4.71 47
93 12.34 123
94 3.62 36
107 4.45 45
135 99.99 999
136 11.69 117
188 9 90
245 24.31 243
246 4.95 50
//
system version 2.2.6-SNAPSHOT