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5,6-Epoxy-retinyl Palmitate

View entire compound with spectra: 1 MS (GC)

5,6-Epoxy-retinyl Palmitate
SpectraBase Compound ID 1UpEDfHPhts
InChI InChI=1S/C36H60O3/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-24-33(37)38-30-26-32(3)23-20-22-31(2)25-29-36-34(4,5)27-21-28-35(36,6)39-36/h20,22-23,25-26,29H,7-19,21,24,27-28,30H2,1-6H3/b23-20+,29-25+,31-22+,32-26+
InChIKey XLBDTOMRSRJZBH-NMJHGEKWSA-N
Mol Weight 540.9 g/mol
Molecular Formula C36H60O3
Exact Mass 540.454246 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K5GuV0nqsNK
Name 5,6-Epoxy-retinyl Palmitate
Alternate Name(s) 5,6-Epoxy-RP 9-(2',6',6'-Trimethyl-1',2'-epoxycyclohex-1'-yl)-3,7-dimethylnona-2,4,6,8-tetraen-1-yl-Palmitate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H60O3
InChI InChI=1S/C36H60O3/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-24-33(37)38-30-26-32(3)23-20-22-31(2)25-29-36-34(4,5)27-21-28-35(36,6)39-36/h20,22-23,25-26,29H,7-19,21,24,27-28,30H2,1-6H3/b23-20+,29-25+,31-22+,32-26+
InChIKey XLBDTOMRSRJZBH-NMJHGEKWSA-N
Molecular Weight 540.873 g/mol
SMILES C12(OC2(CCCC1(C)C)C)\C=C\C(=C\C=C\C(=C\COC(=O)CCCCCCCCCCCCCCC)C)C
SPLASH splash10-001j-0890000000-f6b56717b81cf2c6379e
Source of Spectrum CRT-18-132-fig.3/A
Wiley ID 1710166