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(3S,4S)-3-Phenyl-4-(phenylseleno)-N-(4-heptyl)isoazolidine
SpectraBase Compound ID 5MZ9reYION0
InChI InChI=1S/C22H29NOSe/c1-3-11-19(12-4-2)23-22(18-13-7-5-8-14-18)21(17-24-23)25-20-15-9-6-10-16-20/h5-10,13-16,19,21-22H,3-4,11-12,17H2,1-2H3/t21-,22+/m1/s1
InChIKey QDGQPBNHDMKWJW-YADHBBJMSA-N
Mol Weight 402.45 g/mol
Molecular Formula C22H29NOSe
Exact Mass 403.141437 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 19wlqRgCsaV
Name (3S,4S)-3-Phenyl-4-(phenylseleno)-N-(4-heptyl)isoazolidine
Alternate Name(s) (3S,4S)-3-phenyl-4-(phenylselanyl)-2-(1-propylbutyl)isoxazolidine 3-Phenyl-4-(phenylseleno)-N-(4-heptyl)isoazolidine phenyl (3S,4S)-3-phenyl-2-(1-propylbutyl)isoxazolidinyl selenide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H29NOSe
InChI InChI=1S/C22H29NOSe/c1-3-11-19(12-4-2)23-22(18-13-7-5-8-14-18)21(17-24-23)25-20-15-9-6-10-16-20/h5-10,13-16,19,21-22H,3-4,11-12,17H2,1-2H3/t21-,22+/m1/s1
InChIKey QDGQPBNHDMKWJW-YADHBBJMSA-N
Molecular Weight 402.452 g/mol
SMILES [C@@]1(N(OC[C@]1([Se]c1ccccc1)[H])C(CCC)CCC)(c1ccccc1)[H]
SPLASH splash10-02vl-4900000000-4d2b0a912fa4224ad88d
Source of Spectrum F-51-1283-5
Wiley ID 790735