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1-Naphthalenol, phosphate (3:1)

View entire compound with spectra: 2 NMR, and 1 MS (GC)

1-Naphthalenol, phosphate (3:1)
SpectraBase Compound ID GIW8bqgzWYV
InChI InChI=1S/C30H21O4P/c31-35(32-28-19-7-13-22-10-1-4-16-25(22)28,33-29-20-8-14-23-11-2-5-17-26(23)29)34-30-21-9-15-24-12-3-6-18-27(24)30/h1-21H
InChIKey DBPYGJOORSXBMI-UHFFFAOYSA-N
Mol Weight 476.47 g/mol
Molecular Formula C30H21O4P
Exact Mass 476.117746 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6fB3jYIdqi3
Name 1-Naphthalenol, phosphate (3:1)
Comments Computed using HOSE algorithm
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Exact Mass 476.117746150 u
Formula C30H21O4P
InChI InChI=1S/C30H21O4P/c31-35(32-28-19-7-13-22-10-1-4-16-25(22)28,33-29-20-8-14-23-11-2-5-17-26(23)29)34-30-21-9-15-24-12-3-6-18-27(24)30/h1-21H
InChIKey DBPYGJOORSXBMI-UHFFFAOYSA-N
Molecular Weight 476.468 g/mol
SMILES C1=CC=C2C(OP(OC=3C4=CC=CC=C4C=CC3)(OC=3C4=CC=CC=C4C=CC3)=O)=CC=CC2=C1