MassBank Record: MSBNK-EPA-ENTACT_AGILENT001273
ACCESSION: MSBNK-EPA-ENTACT_AGILENT001273
RECORD_TITLE: N-Methylhydrazinecarbothioamide; ESI-QTOF; MS2; CE: 40; [M+H]+
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY
CH$NAME: N-Methylhydrazinecarbothioamide
CH$NAME: DTXSID7044390
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C2H7N3S
CH$EXACT_MASS: 105.0360679755
CH$SMILES: CNC(=S)NN
CH$IUPAC: InChI=1S/C2H7N3S/c1-4-2(6)5-3/h3H2,1H3,(H2,4,5,6)
CH$LINK: CAS
6610-29-3
CH$LINK: INCHIKEY
PTVZQOAHCSKAAS-UHFFFAOYSA-N
CH$LINK: PUBCHEM
CID:2723853
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 40
MS$FOCUSED_ION: PRECURSOR_M/Z 106.0433444272
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0
PK$SPLASH: splash10-0a4i-9000000000-1cd9a381f7fcf8ca3c6f
PK$NUM_PEAK: 22
PK$PEAK: m/z int. rel.int.
30.033826 10.923519 109
31.029075 7.459191 74
32.049476 2.496903 24
34.994997 2.09486 20
42.021249 2.156189 21
42.033826 9.630268 96
43.029075 6.857467 68
44.979347 12.371204 123
45.032149 6.114247 61
45.044725 1.108131 11
45.974596 10.255361 102
46.982421 55.279751 552
46.994997 15.136857 151
50.005896 3.953981 39
51.026297 2.769147 27
55.029075 20.149048 201
57.044725 99.999996 999
58.982421 25.197567 251
59.990246 10.680869 106
62.005896 77.21046 771
74.005896 16.749469 167
75.001145 2.09627 20
//