Debug Info

object
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_id
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2ds3fsiZrYF
compoundID
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2ds3fsiZrYF
ambiguous
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names
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name
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(4S,2'R,5'E,9'E)-3-(1'-Oxo-2'-prop-2''-enyl-6',10',14'-trimethylpentadeca-5',9',13'-trienyl)-4-benzoxazolidin-2-one
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otherEnantiomer1Compound
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lastUpdated
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(4S,2'R,5'E,9'E)-3-(1'-Oxo-2'-prop-2''-enyl-6',10',14'-trimethylpentadeca-5',9',13'-trienyl)-4-benzoxazolidin-2-one
SpectraBase Compound ID 2ds3fsiZrYF
InChI InChI=1S/C31H43NO3/c1-6-13-28(21-12-18-26(5)17-11-16-25(4)15-10-14-24(2)3)30(33)32-29(23-35-31(32)34)22-27-19-8-7-9-20-27/h6-9,14,16,18-20,28-29H,1,10-13,15,17,21-23H2,2-5H3/b25-16+,26-18+/t28-,29-/m0/s1
InChIKey RHKQYUFXFHCFAD-YQNZAWIUSA-N
Mol Weight 477.7 g/mol
Molecular Formula C31H43NO3
Exact Mass 477.324294 g/mol
Enantiomer InChIKey RHKQYUFXFHCFAD-RELWGFEVSA-N
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  • (4S,2'R,5'E,9'E)-3-(1'-Oxo-2'-prop-2"-enyl-6',10',14'-trimethylpentadeca-5',9',13'-trienyl)-4-benzoxazolidin-2-one
  • (4S)-4-benzyl-3-[(2R,5E,9E)-6,10,14-trimethyl-2-prop-2-enylpentadeca-5,9,13-trienoyl]-1,3-oxazolidin-2-one
  • (S)-3-((R)-2-Allyl-6,10,14-trimethyl-pentadeca-5,9,13-trienoyl)-4-benzyl-oxazolidin-2-one
  • (4S)-4-(phenylmethyl)-3-[(2R,5E,9E)-6,10,14-trimethyl-1-oxo-2-prop-2-enylpentadeca-5,9,13-trienyl]-2-oxazolidinone
  • (4S)-4-(phenylmethyl)-3-[(2R,5E,9E)-6,10,14-trimethyl-2-prop-2-enyl-pentadeca-5,9,13-trienoyl]-1,3-oxazolidin-2-one

This compound is available in the following databases:

Wiley Registry of Mass Spectral Data 2023

Author: Wiley

The foundation library for any analytical laboratory running mass spectrometry, the Wiley Registry provides the broadest coverage available in any mass spectral library Learn more.

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