MassBank Record: MSBNK-EPA-ENTACT_AGILENT001800
ACCESSION: MSBNK-EPA-ENTACT_AGILENT001800
RECORD_TITLE: 1-Piperazineethanol; ESI-QTOF; MS2; CE: 20; [M+H]+
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY
CH$NAME: 1-Piperazineethanol
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H14N2O
CH$EXACT_MASS: 130.1106130837
CH$SMILES: OCCN1CCNCC1
CH$IUPAC: InChI=1S/C6H14N2O/c9-6-5-8-3-1-7-2-4-8/h7,9H,1-6H2
CH$LINK: CAS
103-76-4
CH$LINK: INCHIKEY
WFCSWCVEJLETKA-UHFFFAOYSA-N
CH$LINK: PUBCHEM
CID:7677
AC$INSTRUMENT: N/A
AC$INSTRUMENT_TYPE: ESI-QTOF
AC$MASS_SPECTROMETRY: MS_TYPE MS2
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 20
MS$FOCUSED_ION: PRECURSOR_M/Z 131.1178895354
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0
PK$SPLASH: splash10-001u-9200000000-f421184520c12905ee1a
PK$NUM_PEAK: 32
PK$PEAK: m/z int. rel.int.
41.038577 3.693001 36
42.033826 15.963581 159
43.054227 5.057812 50
44.049476 53.928319 538
45.033491 25.908998 258
45.057301 2.190642 21
56.049476 27.795655 277
57.057301 2.252716 22
58.065126 12.340436 123
61.007276 1.766843 17
63.994366 4.942644 49
68.049476 2.42366 24
70.065126 58.724088 586
71.072951 2.635179 26
72.080776 3.255425 32
74.06004 3.731866 37
79.017841 12.097316 120
83.060375 1.23398 12
84.0682 9.927571 99
84.080776 23.618399 235
85.076025 8.178993 81
86.08385 1.52441 15
87.091675 7.754221 77
88.07569 76.874251 767
88.112076 2.381796 23
89.083515 3.586194 35
98.08385 2.497771 24
99.091675 6.139084 61
100.07569 3.131193 31
113.107325 7.365139 73
129.102239 10.96288 109
131.11789 99.999997 999
//