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(1S,3aS)-1-((R)-1-Chloro-butyl)-2-phenyl-hexahydro-pyrrolo[1,2-c][1,3,2]diazaphopsphole 1-oxide

View entire compound with spectra: 1 MS (GC)

(1S,3aS)-1-((R)-1-Chloro-butyl)-2-phenyl-hexahydro-pyrrolo[1,2-c][1,3,2]diazaphopsphole 1-oxide
SpectraBase Compound ID JUQmL3Ry5zh
InChI InChI=1S/C15H22ClN2OP/c1-2-7-15(16)20(19)17-11-6-10-14(17)12-18(20)13-8-4-3-5-9-13/h3-5,8-9,14-15H,2,6-7,10-12H2,1H3/t14-,15-,20-/m0/s1
InChIKey JCIHKEZGCAYJES-AVYPCKFXSA-N
Mol Weight 312.78 g/mol
Molecular Formula C15H22ClN2OP
Exact Mass 312.115828 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KgVvcPzpQCU
Name (1S,3aS)-1-((R)-1-Chloro-butyl)-2-phenyl-hexahydro-pyrrolo[1,2-c][1,3,2]diazaphopsphole 1-oxide
Alternate Name(s) (1S,3aS)-1-((R)-1-chlorobutyl)-2-phenylhexahydro-1H-pyrrolo[1,2-c][1,3,2]diazaphosphole 1-oxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22ClN2OP
InChI InChI=1S/C15H22ClN2OP/c1-2-7-15(16)20(19)17-11-6-10-14(17)12-18(20)13-8-4-3-5-9-13/h3-5,8-9,14-15H,2,6-7,10-12H2,1H3/t14-,15-,20-/m0/s1
InChIKey JCIHKEZGCAYJES-AVYPCKFXSA-N
Literature Reference DOI 10.1002_1098-1071(2000)11_7_528
Molecular Weight 312.781 g/mol
SMILES [C@]([P@@]1(N2[C@@](CCC2)(CN1c1ccccc1)[H])=O)(Cl)(CCC)[H]
SPLASH splash10-02mi-0696000000-3d6dbd5663900af498fc
Source of Spectrum HAC-11-532-4c
Wiley ID 1775821