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(1S,3aS)-1-((S)-1-Chloro-pentyl)-2-phenyl-hexahydro-pyrrolo[1,2-c][1,3,2]diazaphopsphole 1-oxide
SpectraBase Compound ID JQoT75xVsPI
InChI InChI=1S/C16H24ClN2OP/c1-2-3-11-16(17)21(20)18-12-7-10-15(18)13-19(21)14-8-5-4-6-9-14/h4-6,8-9,15-16H,2-3,7,10-13H2,1H3/t15-,16+,21-/m0/s1
InChIKey AIFWJWWZGLQORY-MRUHUIDDSA-N
Mol Weight 326.81 g/mol
Molecular Formula C16H24ClN2OP
Exact Mass 326.131478 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CCn1JTUeeFl
Name (1S,3aS)-1-((S)-1-Chloro-pentyl)-2-phenyl-hexahydro-pyrrolo[1,2-c][1,3,2]diazaphopsphole 1-oxide
Alternate Name(s) (1S,3aS)-1-((S)-1-chloropentyl)-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 C16H24ClN2OP
InChI InChI=1S/C16H24ClN2OP/c1-2-3-11-16(17)21(20)18-12-7-10-15(18)13-19(21)14-8-5-4-6-9-14/h4-6,8-9,15-16H,2-3,7,10-13H2,1H3/t15-,16+,21-/m0/s1
InChIKey AIFWJWWZGLQORY-MRUHUIDDSA-N
Literature Reference DOI 10.1002_1098-1071(2000)11_7_528
Molecular Weight 326.808 g/mol
SMILES [C@]([P@@]1(=O)N(c2ccccc2)C[C@@]2(CCCN12)[H])(CCCC)(Cl)[H]
SPLASH splash10-0100-0596000000-096f7139fcd73a9d788b
Source of Spectrum HAC-11-533-6e
Wiley ID 1775830