MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP004633

EXO-7-METHYLBICYCLO(4.1.0)HEPT-2-EN-ENDO-7-PROPANAL; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004633
RECORD_TITLE: EXO-7-METHYLBICYCLO(4.1.0)HEPT-2-EN-ENDO-7-PROPANAL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KATO T, DEPT. OF CHEM., FAC. OF SCI., TOHOKU UNIV.
LICENSE: CC BY-NC-SA

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CH$NAME: EXO-7-METHYLBICYCLO(4.1.0)HEPT-2-EN-ENDO-7-PROPANAL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₁H₁₆O
CH$EXACT_MASS: 164.12012
CH$SMILES: O=CCCC(C)(C([H])21)C([H])(C=CCC2)1
CH$IUPAC: InChI=1S/C11H16O/c1-11(7-4-8-12)9-5-2-3-6-10(9)11/h2,5,8-10H,3-4,6-7H2,1H3/t9-,10+,11-/m1/s1
CH$LINK: INCHIKEY COWXSOPBSILZLU-OUAUKWLOSA-N

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AC$INSTRUMENT: HITACHI M-52
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 14 eV

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MS$FOCUSED_ION: ION_TYPE [M]+*

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PK$SPLASH: splash10-00di-2900000000-866a6ca2bae99e44073b
PK$NUM_PEAK: 20
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//