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Hexenyl angelate<3Z->
SpectraBase Compound ID 82otvVN3zV0
InChI InChI=1S/C11H18O2/c1-4-6-7-8-9-13-11(12)10(3)5-2/h5-7H,4,8-9H2,1-3H3/b7-6-,10-5-
InChIKey JNWQKXUWZWKUAY-BHHIIOOYSA-N
Mol Weight 182.26 g/mol
Molecular Formula C11H18O2
Exact Mass 182.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 54BLgEreIHk
Name Hexenyl angelate <(3Z)->
CAS Registry Number 84060-80-0
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 182.130679818 u
Formula C11H18O2
InChI InChI=1S/C11H18O2/c1-4-6-7-8-9-13-11(12)10(3)5-2/h5-7H,4,8-9H2,1-3H3/b7-6-,10-5-
InChIKey JNWQKXUWZWKUAY-BHHIIOOYSA-N
Molecular Weight 182.263 g/mol
Number of Peaks 30
RI1 1279
SMILES C(\C(=C/C)C)(=O)OCC\C=C/CC
SPLASH splash10-001i-9000000000-f9dec95e0293968b80a0
Sample Comments RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 2-Butenoic acid, 2-methyl-, (3Z)-3-hexen-1-yl ester, (2Z)-
Wiley ID LM_FFNSC3_2524