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Ethyl trans-13,14-dihydro-13-desmethyl-13,14-methyleneretinoates
SpectraBase Compound ID 1LJZmGtR04k
InChI InChI=1S/C22H32O2/c1-6-24-21(23)19-15-18(19)11-7-9-16(2)12-13-20-17(3)10-8-14-22(20,4)5/h7,9,11-13,18-19H,6,8,10,14-15H2,1-5H3/b11-7+,13-12+,16-9+/t18-,19-/m1/s1
InChIKey UCMHLZAAZMANLJ-XRNAHFLLSA-N
Mol Weight 328.5 g/mol
Molecular Formula C22H32O2
Exact Mass 328.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID rugJBVONLV
Name Ethyl trans-13,14-dihydro-13-desmethyl-13,14-methyleneretinoates
CAS Registry Number 89887-40-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H32O2
InChI InChI=1S/C22H32O2/c1-6-24-21(23)19-15-18(19)11-7-9-16(2)12-13-20-17(3)10-8-14-22(20,4)5/h7,9,11-13,18-19H,6,8,10,14-15H2,1-5H3/b11-7+,13-12+,16-9+/t18-,19-/m1/s1
InChIKey UCMHLZAAZMANLJ-XRNAHFLLSA-N
Molecular Weight 328.496 g/mol
SMILES [C@@]1(C[C@]1(\C=C\C=C\(\C=C\C1=C(CCCC1(C)C)C)C)[H])(C(=O)OCC)[H]
SPLASH splash10-004i-0009000000-3ab5344e26a43ced6916
Source of Spectrum J-49-1943-0
Synonyms Ethyl (1R,2S)-2-[(1E,3E,5E)-4-methyl-6-(2,6,6-trimethyl-1-cyclohexen-1-yl)-1,3,5-hexatrienyl]cyclopropanecarboxylate
Wiley ID 1326796