MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP011301
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011301
RECORD_TITLE: ISOBUTYL VINYL ETHER; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: ISOBUTYL VINYL ETHER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H12O
CH$EXACT_MASS: 100.08882
CH$SMILES: C=COCC(C)C
CH$IUPAC: InChI=1S/C6H12O/c1-4-7-5-6(2)3/h4,6H,1,5H2,2-3H3
CH$LINK: CAS
109-53-5
CH$LINK: COMPTOX
DTXSID8029608
CH$LINK: INCHIKEY
OZCMOJQQLBXBKI-UHFFFAOYSA-N
CH$LINK: PUBCHEM
CID:7992
AC$INSTRUMENT: HITACHI M-2500
AC$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$SPLASH: splash10-0a6u-9000000000-25e7de3edb227c6e46d2
PK$NUM_PEAK: 27
PK$PEAK: m/z int. rel.int.
14 1.76 18
15 8.94 89
26 5.56 56
27 37.21 372
28 6.74 67
29 53.3 533
30 1.24 12
31 12.29 123
37 1.12 11
38 3.26 33
39 35.68 357
40 5.13 51
41 99.99 999
42 8.56 86
43 10.44 104
44 15.8 158
45 6.17 62
50 1.16 12
51 1.33 13
53 2.65 27
55 10.83 108
56 48.34 483
57 73.89 739
58 3.97 40
59 1.83 18
100 13.98 140
101 1.66 17
//