MassBank Record: MSBNK-EPA-ENTACT_AGILENT001221
ACCESSION: MSBNK-EPA-ENTACT_AGILENT001221
RECORD_TITLE: 3-[3,5-DI(tert-butyl)-4-hydroxyphenyl]propanohydrazide; ESI-QTOF; MS2; CE: 40; [M-H]-
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY
CH$NAME: 3-[3,5-DI(tert-butyl)-4-hydroxyphenyl]propanohydrazide
CH$NAME: DTXSID1027978
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C17H28N2O2
CH$EXACT_MASS: 292.2150781526
CH$SMILES: CC(C)(C)C1C=C(CCC(=O)NN)C=C(C=1O)C(C)(C)C
CH$IUPAC: InChI=1S/C17H28N2O2/c1-16(2,3)12-9-11(7-8-14(20)19-18)10-13(15(12)21)17(4,5)6/h9-10,21H,7-8,18H2,1-6H3,(H,19,20)
CH$LINK: CAS
32687-77-7
CH$LINK: INCHIKEY
KMWIPXLIKIAZMT-UHFFFAOYSA-N
CH$LINK: PUBCHEM
CID:64865
AC$INSTRUMENT: N/A
AC$INSTRUMENT_TYPE: ESI-QTOF
AC$MASS_SPECTROMETRY: MS_TYPE MS2
AC$MASS_SPECTROMETRY: ION_MODE NEGATIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 40
MS$FOCUSED_ION: PRECURSOR_M/Z 291.2078017009
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0
PK$SPLASH: splash10-00di-9000000000-bce3dc17c95291056553
PK$NUM_PEAK: 10
PK$PEAK: m/z int. rel.int.
41.003288 1.340971 13
41.998537 42.135291 420
43.006362 1.577145 15
57.022012 31.118503 310
73.040736 99.999996 999
73.077122 2.172091 21
119.050238 1.078131 10
175.112839 1.188038 11
218.167614 1.470478 14
231.175439 6.400999 63
//