MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP002567
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002567
RECORD_TITLE: CYCLOHEXYLAMINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: CYCLOHEXYLAMINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H13N
CH$EXACT_MASS: 99.10480
CH$SMILES: NC(C1)CCCC1
CH$IUPAC: InChI=1S/C6H13N/c7-6-4-2-1-3-5-6/h6H,1-5,7H2
CH$LINK: INCHIKEY
PAFZNILMFXTMIY-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID1023996
AC$INSTRUMENT: HITACHI RMU-6M
AC$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$SPLASH: splash10-0a4i-9000000000-9f0030286662e0b15eb9
PK$NUM_PEAK: 19
PK$PEAK: m/z int. rel.int.
15 1.16 12
27 4.41 44
28 6.96 70
29 2.57 26
30 9.14 91
39 3.83 38
41 3.85 39
42 4.37 44
43 20.31 203
53 1.25 13
54 1.52 15
55 2.03 20
56 99.99 999
57 4.85 49
67 1.39 14
70 6.38 64
98 1.48 15
99 13.59 136
100 1.03 10
//