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trans-1-Acetoxy-2-n-butyl-3-cyclohexene
SpectraBase Compound ID I87p6RZhz0y
InChI InChI=1S/C12H20O2/c1-3-4-7-11-8-5-6-9-12(11)14-10(2)13/h5,8,11-12H,3-4,6-7,9H2,1-2H3/t11-,12-/m0/s1
InChIKey RVNJPFPKSXNHAM-RYUDHWBXSA-N
Mol Weight 196.29 g/mol
Molecular Formula C12H20O2
Exact Mass 196.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GuYSy91T5Ga
Name trans-1-Acetoxy-2-n-butyl-3-cyclohexene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O2
InChI InChI=1S/C12H20O2/c1-3-4-7-11-8-5-6-9-12(11)14-10(2)13/h5,8,11-12H,3-4,6-7,9H2,1-2H3/t11-,12-/m0/s1
InChIKey RVNJPFPKSXNHAM-RYUDHWBXSA-N
Molecular Weight 196.290 g/mol
SMILES C(O[C@@]1([C@](C=CCC1)(CCCC)[H])[H])(=O)C
SPLASH splash10-004i-9100000000-c221b02ee02beaeba316
Source of Spectrum QE-1-358-14
Synonyms (1S,2S)-2-butyl-3-cyclohexen-1-yl acetate
Wiley ID 842454