Product NameDibenzyl phosphate
CAS1623-08-1
Molecular FormulaC14H15O4P
Molecular Weight278.24
InChIInChI=1S/C14H15O4P/c15-19(16,17-11-13-7-3-1-4-8-13)18-12-14-9-5-2-6-10-14/h1-10H,11-12H2,(H,15,16)
InChIKey HDFFVHSMHLDSLO-UHFFFAOYSA-N
SmilesP(O)(OCC1=CC=CC=C1)(OCC1=CC=CC=C1)=O
Mass
MS-IW-4007 dibenzyl hydrogen phosphate C14H15O4P (Mass of molecular ion: 278)
Source Temperature: 180 °C Sample Temperature: 150 °C Direct, 75 eV
39.0 1.6 51.0 1.3 63.0 1.3 65.0 8.1 77.0 3.2 79.0 3.7 89.0 2.6 90.0 2.5 91.0 100.0 92.0 10.6 105.0 2.9 107.0 12.0 108.0 1.7 178.0 1.1 179.0 3.8 180.0 8.6 181.0 1.4 187.0 14.7 188.0 1.6 277.0 20.2 278.0 3.3
400 MHz in CDCl3
1H NMR | 399.65 MHz |
C14 H15 O4 P | 0.05 ml : 0.5 ml CDCl3 |
dibenzyl hydrogen phosphate |
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Assign. Shift(ppm) |
Hz ppm Int.
4708.86 11.783 64 2924.65 7.319 57 2923.28 7.315 57 2920.84 7.309 232 2918.70 7.304 1000 2915.95 7.297 271 2913.82 7.291 91 2911.53 7.286 48 2909.85 7.281 39 2909.24 7.280 39 2908.17 7.277 36 2000.89 5.007 270 1993.41 4.988 270
in CDCl3
KBr disc
nujol mull
Dibenzyl phosphate(1623-08-1) MS Atlas of Related Products
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