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(1R,4S)-(-)-Benzyl-N-{1-[2-(2,2-dimethyl-5-oxo-1,3-dioxan-4-yl)ethyltridecyl]carbamate
SpectraBase Compound ID 83nnFWpeWpm
InChI InChI=1S/C29H47NO5/c1-4-5-6-7-8-9-10-11-12-16-19-25(20-21-27-26(31)23-34-29(2,3)35-27)30-28(32)33-22-24-17-14-13-15-18-24/h13-15,17-18,25,27H,4-12,16,19-23H2,1-3H3,(H,30,32)/t25-,27+/m1/s1
InChIKey WGZUGGYARZEIMA-VPUSJEBWSA-N
Mol Weight 489.7 g/mol
Molecular Formula C29H47NO5
Exact Mass 489.345424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4ZHIWN7cdYl
Name (1R,4S)-(-)-Benzyl-N-{1-[2-(2,2-dimethyl-5-oxo-1,3-dioxan-4-yl)ethyltridecyl]carbamate
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Formula C29H47NO5
InChI InChI=1S/C29H47NO5/c1-4-5-6-7-8-9-10-11-12-16-19-25(20-21-27-26(31)23-34-29(2,3)35-27)30-28(32)33-22-24-17-14-13-15-18-24/h13-15,17-18,25,27H,4-12,16,19-23H2,1-3H3,(H,30,32)/t25-,27+/m1/s1
InChIKey WGZUGGYARZEIMA-VPUSJEBWSA-N
Molecular Weight 489.697 g/mol
SMILES N(C(=O)OCc1ccccc1)[C@@](CC[C@]1(C(COC(O1)(C)C)=O)[H])(CCCCCCCCCCCC)[H]
SPLASH splash10-0006-9040100000-da6551bbb1eb6c3b3c69
Source of Spectrum SO-0-2104-16
Synonyms N-[(3R)-1-[(4S)-2,2-dimethyl-5-oxo-1,3-dioxan-4-yl]pentadecan-3-yl]carbamic acid (phenylmethyl) ester benzyl N-[(3R)-1-[(4S)-2,2-dimethyl-5-oxo-1,3-dioxan-4-yl]pentadecan-3-yl]carbamate benzyl N-[(1R)-1-[2-[(4S)-2,2-dimethyl-5-oxo-1,3-dioxan-4-yl]ethyl]tridecyl]carbamate (phenylmethyl) N-[(3R)-1-[(4S)-2,2-dimethyl-5-oxidanylidene-1,3-dioxan-4-yl]pentadecan-3-yl]carbamate
Wiley ID 878398