MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP003613
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003613
RECORD_TITLE: N-ETHYLCYCLOHEXYLAMINE; 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$NAME: N-ETHYLCYCLOHEXYLAMINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H17N
CH$EXACT_MASS: 127.13610
CH$SMILES: CCNC(C1)CCCC1
CH$IUPAC: InChI=1S/C8H17N/c1-2-9-8-6-4-3-5-7-8/h8-9H,2-7H2,1H3
CH$LINK: INCHIKEY
AGVKXDPPPSLISR-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID8063913
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: splash10-001i-9000000000-ea20c394896970427193
PK$NUM_PEAK: 35
PK$PEAK: m/z int. rel.int.
15 6.5 65
18 3 30
26 3 30
27 1.98 20
28 25 250
29 15 150
30 14.3 143
39 0.92 9
40 2.5 25
41 16 160
42 9 90
43 0.5 5
44 8 80
50 1 10
51 2 20
53 0.4 4
54 3.9 39
55 8.5 85
56 4 40
57 0.23 2
58 4.8 48
67 3.5 35
68 3 30
69 0.4 4
70 3.5 35
71 14 140
81 3 30
82 0.35 4
83 3 30
84 99.99 999
85 6.8 68
98 0.4 4
112 2.6 26
126 2.5 25
127 11 110
//
system version 2.2.8-SNAPSHOT