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8-Benzoyl-7-hydroxy-4,6-dimethyl-5-oxooct-3-yl phenylcarbamate

View entire compound with spectra: 1 MS (GC)

8-Benzoyl-7-hydroxy-4,6-dimethyl-5-oxooct-3-yl phenylcarbamate
SpectraBase Compound ID 3Ugb8yOBuaQ
InChI InChI=1S/C24H29NO5/c1-4-22(30-24(29)25-19-13-9-6-10-14-19)17(3)23(28)16(2)20(26)15-21(27)18-11-7-5-8-12-18/h5-14,16-17,20,22,26H,4,15H2,1-3H3,(H,25,29)/t16-,17-,20+,22-/m0/s1
InChIKey FNQROYXIOYWESJ-SXMNSQCDSA-N
Mol Weight 411.5 g/mol
Molecular Formula C24H29NO5
Exact Mass 411.204573 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7gEePeHAO2w
Name 8-Benzoyl-7-hydroxy-4,6-dimethyl-5-oxooct-3-yl phenylcarbamate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H29NO5
InChI InChI=1S/C24H29NO5/c1-4-22(30-24(29)25-19-13-9-6-10-14-19)17(3)23(28)16(2)20(26)15-21(27)18-11-7-5-8-12-18/h5-14,16-17,20,22,26H,4,15H2,1-3H3,(H,25,29)/t16-,17-,20+,22-/m0/s1
InChIKey FNQROYXIOYWESJ-SXMNSQCDSA-N
Molecular Weight 411.498 g/mol
SMILES O[C@@]([C@@](C([C@]([C@@](OC(Nc1ccccc1)=O)(CC)[H])(C)[H])=O)(C)[H])(CC(=O)c1ccccc1)[H]
SPLASH splash10-0006-9200100000-569930e8a751e7f80152
Source of Spectrum J-61-3928-5
Synonyms 1-Ethyl-5-hydroxy-2,4-dimethyl-3,7-dioxo-7-phenylheptyl phenylcarbamate Phenyl-carbamic acid (1S,2S,4S,5R)-1-ethyl-5-hydroxy-2,4-dimethyl-3,7-dioxo-7-phenyl-heptyl ester
Wiley ID 1374147