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Benzoic acid, 2-(3,3'-dioxo-1,1'-spirobi[2,1-benzoxaphosphol]-1(3'H,3H)-yl)-
SpectraBase Compound ID CShgsQ9UfVX
InChI InChI=1S/C21H13O6P/c22-19(23)13-7-1-4-10-16(13)28(17-11-5-2-8-14(17)20(24)26-28)18-12-6-3-9-15(18)21(25)27-28/h1-12H,(H,22,23)
InChIKey KGCDZMDTGSWODN-UHFFFAOYSA-N
Mol Weight 392.3 g/mol
Molecular Formula C21H13O6P
Exact Mass 392.044975 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LfDPPqBdUk8
Name Benzoic acid, 2-(3,3'-dioxo-1,1'-spirobi[2,1-benzoxaphosphol]-1(3'H,3H)-yl)-
Alternate Name(s) 2-(3,3'-dioxo-1,1'-spirobi[2,1$l^{5}-benzoxaphosphole]-1-yl)benzoic acid 2-[3,3'-bis(oxidanylidene)-1,1'-spirobi[2,1$l^{5}-benzoxaphosphole]-1-yl]benzoic acid NSC 299862
CAS Registry Number 57322-20-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H13O6P
InChI InChI=1S/C21H13O6P/c22-19(23)13-7-1-4-10-16(13)28(17-11-5-2-8-14(17)20(24)26-28)18-12-6-3-9-15(18)21(25)27-28/h1-12H,(H,22,23)
InChIKey KGCDZMDTGSWODN-UHFFFAOYSA-N
Molecular Weight 392.303 g/mol
SMILES OC(=O)c1c(cccc1)P12(c3c(cccc3)C(O1)=O)c1c(cccc1)C(O2)=O
SPLASH splash10-0udi-0596000000-90241058b63defa7dab9
Source of Spectrum C-100-5133-0
Wiley ID 1365746