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(R,R,)2-Benzylaminoperhydro-1,3,2-benzodiazaphosphole 2-oxide

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

(R,R,)2-Benzylaminoperhydro-1,3,2-benzodiazaphosphole 2-oxide
SpectraBase Compound ID 4UyWI1FvoLD
InChI InChI=1S/C15H24N3OP/c1-17-14-10-6-7-11-15(14)18(2)20(17,19)16-12-13-8-4-3-5-9-13/h3-5,8-9,14-15H,6-7,10-12H2,1-2H3,(H,16,19)/t14-,15-/m1/s1
InChIKey XVWKMELFKXDHGB-HUUCEWRRSA-N
Mol Weight 293.35 g/mol
Molecular Formula C15H24N3OP
Exact Mass 293.165699 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J570MPgvsy9
Name (R,R,)2-Benzylaminoperhydro-1,3,2-benzodiazaphosphole 2-oxide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 293.165699402 u
Formula C15H24N3OP
InChI InChI=1S/C15H24N3OP/c1-17-14-10-6-7-11-15(14)18(2)20(17,19)16-12-13-8-4-3-5-9-13/h3-5,8-9,14-15H,6-7,10-12H2,1-2H3,(H,16,19)/t14-,15-/m1/s1
InChIKey XVWKMELFKXDHGB-HUUCEWRRSA-N
Molecular Weight 293.351 g/mol
SMILES [C@@]12(N(P(N([C@@]1(CCCC2)[H])C)(NCC1=CC=CC=C1)=O)C)[H]