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syn-(4RS,5RS,E)-5-(Diphenylphosphinoyl)dec-2-en-4-yl Nitrobenzoate
SpectraBase Compound ID BN5kwTZASnp
InChI InChI=1S/C29H32NO5P/c1-3-5-8-18-28(36(34,25-14-9-6-10-15-25)26-16-11-7-12-17-26)27(13-4-2)35-29(31)23-19-21-24(22-20-23)30(32)33/h4,6-7,9-17,19-22,27-28H,3,5,8,18H2,1-2H3/b13-4+/t27-,28-/m0/s1
InChIKey BYWKHPHAZFWNML-GITWVAICSA-N
Mol Weight 505.6 g/mol
Molecular Formula C29H32NO5P
Exact Mass 505.20181 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 60sXpYm98Gy
Name syn-(4RS,5RS,E)-5-(Diphenylphosphinoyl)dec-2-en-4-yl Nitrobenzoate
Alternate Name(s) (2E)-1-[1-(diphenylphosphoryl)hexyl]-2-butenyl 2-nitrobenzoate anti-(4RS,5SR,E)-5-(Diphenylphosphinoyl)dec-2-en-4-yl Nitrobenzoate syn-(4RS,5RS,E)-5-(Diphenylphosphinoyl)dec-2-en-4-yl 4-Nitrobenzoate
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Formula C29H32NO5P
InChI InChI=1S/C29H32NO5P/c1-3-5-8-18-28(36(34,25-14-9-6-10-15-25)26-16-11-7-12-17-26)27(13-4-2)35-29(31)23-19-21-24(22-20-23)30(32)33/h4,6-7,9-17,19-22,27-28H,3,5,8,18H2,1-2H3/b13-4+/t27-,28-/m0/s1
InChIKey BYWKHPHAZFWNML-GITWVAICSA-N
Molecular Weight 505.551 g/mol
SMILES [C@](P(=O)(c1ccccc1)c1ccccc1)([C@@](OC(c1ccc(N(=O)=O)cc1)=O)(\C=C\C)[H])(CCCCC)[H]
SPLASH splash10-0udi-0093000000-64a0c2b55b9334279619
Source of Spectrum KC-1993-1853-15
Wiley ID 778623