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Tetra-o-neopentyl-asym-monoselenopyrophosphate

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

Tetra-o-neopentyl-asym-monoselenopyrophosphate
SpectraBase Compound ID Hf679g6di8x
InChI InChI=1S/C20H44O6P2Se/c1-17(2,3)13-22-27(21,23-14-18(4,5)6)26-28(29,24-15-19(7,8)9)25-16-20(10,11)12/h13-16H2,1-12H3
InChIKey YRUVSLUDASHWKM-UHFFFAOYSA-N
Mol Weight 521.5 g/mol
Molecular Formula C20H44O6P2Se
Exact Mass 522.177835 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GUn95KPk9fr
Name Tetra-o-neopentyl-asym-monoselenopyrophosphate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 522.177835127 u
Formula C20H44O6P2Se
InChI InChI=1S/C20H44O6P2Se/c1-17(2,3)13-22-27(21,23-14-18(4,5)6)26-28(29,24-15-19(7,8)9)25-16-20(10,11)12/h13-16H2,1-12H3
InChIKey YRUVSLUDASHWKM-UHFFFAOYSA-N
Molecular Weight 521.485 g/mol
SMILES C(OP(OP(=[Se])(OCC(C)(C)C)OCC(C)(C)C)(=O)OCC(C)(C)C)C(C)(C)C