For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

4,8-Ditert-butyl-N,N-diethyl-2,10-dimethyl-12H-dibenzo[D,G][1,3,2]dioxaphosphocin-6-amine

View entire compound with spectra: 1 NMR

4,8-Ditert-butyl-N,N-diethyl-2,10-dimethyl-12H-dibenzo[D,G][1,3,2]dioxaphosphocin-6-amine
SpectraBase Compound ID BvETntzudtP
InChI InChI=1S/C27H40NO2P/c1-11-28(12-2)31-29-24-20(13-18(3)15-22(24)26(5,6)7)17-21-14-19(4)16-23(25(21)30-31)27(8,9)10/h13-16H,11-12,17H2,1-10H3
InChIKey NRGOJRVWTVSCJH-UHFFFAOYSA-N
Mol Weight 441.6 g/mol
Molecular Formula C27H40NO2P
Exact Mass 441.279667 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 59zEUEAbizd
Name 4,8-Ditert-butyl-N,N-diethyl-2,10-dimethyl-12H-dibenzo[D,G][1,3,2]dioxaphosphocin-6-amine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 441.279666528 u
Formula C27H40NO2P
InChI InChI=1S/C27H40NO2P/c1-11-28(12-2)31-29-24-20(13-18(3)15-22(24)26(5,6)7)17-21-14-19(4)16-23(25(21)30-31)27(8,9)10/h13-16H,11-12,17H2,1-10H3
InChIKey NRGOJRVWTVSCJH-UHFFFAOYSA-N
Molecular Weight 441.596 g/mol
SMILES C1=2OP(OC3=C(CC2C=C(C=C1C(C)(C)C)C)C=C(C=C3C(C)(C)C)C)N(CC)CC