MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP009409
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009409
RECORD_TITLE: PROPYL CHLOROFORMATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA
CH$NAME: PROPYL CHLOROFORMATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C4H7ClO2
CH$EXACT_MASS: 122.01346
CH$SMILES: CCCOC(=O)Cl
CH$IUPAC: InChI=1S/C4H7ClO2/c1-2-3-7-4(5)6/h2-3H2,1H3
CH$LINK: INCHIKEY
QQKDTTWZXHEGAQ-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID3042342
AC$INSTRUMENT: HITACHI M-80A
AC$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$SPLASH: splash10-0006-9000000000-7f29b529441740743e44
PK$NUM_PEAK: 26
PK$PEAK: m/z int. rel.int.
14 2.42 24
15 9.21 92
16 2.23 22
26 9.98 100
27 54.05 541
29 15.48 155
30 3.76 38
31 5.64 56
35 4.34 43
36 4.05 41
37 3.09 31
38 5.42 54
39 23.97 240
40 6.61 66
41 48.63 486
42 83.79 838
43 99.99 999
44 14.81 148
45 1.49 15
57 2.6 26
59 5.08 51
63 25.6 256
65 8.44 84
78 1.08 11
93 6.79 68
95 2.18 22
//