MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP004933
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004933
RECORD_TITLE: GAMMA-BUTYROLACTONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA
CH$NAME: GAMMA-BUTYROLACTONE
CH$NAME: DIHYDRO-2(3H)-FURANONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C4H6O2
CH$EXACT_MASS: 86.03678
CH$SMILES: O=C(C1)OCC1
CH$IUPAC: InChI=1S/C4H6O2/c5-4-2-1-3-6-4/h1-3H2
CH$LINK: INCHIKEY
YEJRWHAVMIAJKC-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID6020224
AC$INSTRUMENT: JEOL JMS-D-3000
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-c2f6d51e7b2f9ce1e9f1
PK$NUM_PEAK: 11
PK$PEAK: m/z int. rel.int.
40 16.4 164
42 99.99 999
43 6.51 65
44 3.05 31
53 1.41 14
55 9.09 91
56 31.57 316
57 6.03 60
85 14.23 142
86 36.31 363
87 1.77 18
//