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Phenyl retinoate

View entire compound with spectra: 1 MS (GC)

Phenyl retinoate
SpectraBase Compound ID HltcUYe9jTI
InChI InChI=1S/C26H32O2/c1-20(16-17-24-22(3)13-10-18-26(24,4)5)11-9-12-21(2)19-25(27)28-23-14-7-6-8-15-23/h6-9,11-12,14-17,19H,10,13,18H2,1-5H3/b12-9+,17-16+,20-11+,21-19+
InChIKey UGFCGMLNBQXNIQ-GFDJYDRDSA-N
Mol Weight 376.5 g/mol
Molecular Formula C26H32O2
Exact Mass 376.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EDnF32zryWN
Name Phenyl retinoate
Alternate Name(s) (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)nona-2,4,6,8-tetraenoic acid phenyl ester phenyl (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoate
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Formula C26H32O2
InChI InChI=1S/C26H32O2/c1-20(16-17-24-22(3)13-10-18-26(24,4)5)11-9-12-21(2)19-25(27)28-23-14-7-6-8-15-23/h6-9,11-12,14-17,19H,10,13,18H2,1-5H3/b12-9+,17-16+,20-11+,21-19+
InChIKey UGFCGMLNBQXNIQ-GFDJYDRDSA-N
Molecular Weight 376.540 g/mol
SMILES C1(\C=C\C(=C\C=C\C(=C\C(Oc2ccccc2)=O)C)C)=C(CCCC1(C)C)C
SPLASH splash10-001i-0093000000-692d018a32a6ab459658
Source of Spectrum F-67-6873-a
Wiley ID 1687415