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3-Hexanone, 4-(diphenylphosphinyl)-6-hydroxy-
SpectraBase Compound ID ImvO5oLvjcF
InChI InChI=1S/C18H21O3P/c1-2-17(20)18(13-14-19)22(21,15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,18-19H,2,13-14H2,1H3
InChIKey PGMIBVQFHRYJNO-UHFFFAOYSA-N
Mol Weight 316.34 g/mol
Molecular Formula C18H21O3P
Exact Mass 316.122832 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CiiZcT9Qibu
Name 3-Hexanone, 4-(diphenylphosphinyl)-6-hydroxy-
Alternate Name(s) 4-(diphenylphosphoryl)-6-hydroxy-3-hexanone 4-Diphenylphosphinoyl-6-hydroxyhexan-3-one
CAS Registry Number 101680-90-4
Comments Less than 3 mono-isotopic peaks
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Formula C18H21O3P
InChI InChI=1S/C18H21O3P/c1-2-17(20)18(13-14-19)22(21,15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,18-19H,2,13-14H2,1H3
InChIKey PGMIBVQFHRYJNO-UHFFFAOYSA-N
Molecular Weight 316.337 g/mol
SMILES OCCC(P(=O)(c1ccccc1)c1ccccc1)C(=O)CC
SPLASH splash10-0f6t-0090000000-ebf45b4f395759c62219
Source of Spectrum KC-1988-2975-8
Wiley ID 1316834