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dibutyl cis-4-cyclohexene-1,2-dicarboxylate
SpectraBase Compound ID FRwoOiwV1Bk
InChI InChI=1S/C16H26O4/c1-3-5-11-19-15(17)13-9-7-8-10-14(13)16(18)20-12-6-4-2/h7-8,13-14H,3-6,9-12H2,1-2H3/t13-,14+
InChIKey ANOXPYCDNXHEEE-OKILXGFUSA-N
Mol Weight 282.38 g/mol
Molecular Formula C16H26O4
Exact Mass 282.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CBM6ADeOoKc
Name dibutyl cis-4-cyclohexene-1,2-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H26O4
InChI InChI=1S/C16H26O4/c1-3-5-11-19-15(17)13-9-7-8-10-14(13)16(18)20-12-6-4-2/h7-8,13-14H,3-6,9-12H2,1-2H3/t13-,14+
InChIKey ANOXPYCDNXHEEE-OKILXGFUSA-N
Literature Reference DOI 10.1002/cssc.201800646
Molecular Weight 282.380 g/mol
SMILES C(C)CCOC(=O)[C@]1(CC=CC[C@]1(C(=O)OCCCC)[H])[H]
SPLASH splash10-004i-9600000000-53b7e720ff30191f6f1c
Source of Spectrum CSC-11-SM26-SM26_3
Synonyms dibutyl (1R,2S)-cyclohex-4-ene-1,2-dicarboxylate
Wiley ID 1813577