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(2R*,4aR*,8aR*/2S*,4aR*,8aR*)-1,3-dimethyl-2-phenoxy-4a,5,6,7,8,8a-hexahydro-4H-benzo[d][1,3,2]diazaphosphinine 2-oxide
SpectraBase Compound ID CXZOqg0CpPT
InChI InChI=1S/C15H23N2O2P/c1-16-12-13-8-6-7-11-15(13)17(2)20(16,18)19-14-9-4-3-5-10-14/h3-5,9-10,13,15H,6-8,11-12H2,1-2H3
InChIKey QANMDXDFWGJJDY-UHFFFAOYSA-N
Mol Weight 294.33 g/mol
Molecular Formula C15H23N2O2P
Exact Mass 294.149715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B45y3uFZiNc
Name (2R*,4aR*,8aR*/2S*,4aR*,8aR*)-1,3-dimethyl-2-phenoxy-4a,5,6,7,8,8a-hexahydro-4H-benzo[d][1,3,2]diazaphosphinine 2-oxide
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Formula C15H23N2O2P
InChI InChI=1S/C15H23N2O2P/c1-16-12-13-8-6-7-11-15(13)17(2)20(16,18)19-14-9-4-3-5-10-14/h3-5,9-10,13,15H,6-8,11-12H2,1-2H3
InChIKey QANMDXDFWGJJDY-UHFFFAOYSA-N
Instrument Name VG ZabSpec
Ionization Type EI
Literature Reference DOI 10.1002/rcm.2481
Molecular Weight 294.335 g/mol
SMILES C1CC2C(CC1)N(P(N(C2)C)(Oc1ccccc1)=O)C
SPLASH splash10-0udl-3090000000-88d1f1dcb0da4715d458
Sample Comments 2:1 mixture of epimers 13a/13b
Source of Spectrum RCM-20-1623-13
Wiley ID 1836464