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Carbamic acid, [1-butyl-2-(phenylseleno)hexyl]-, cyclohexyl ester, (R*,S*)-
SpectraBase Compound ID 6oclCLDUFZF
InChI InChI=1S/C23H37NO2Se/c1-3-5-17-21(24-23(25)26-19-13-9-7-10-14-19)22(18-6-4-2)27-20-15-11-8-12-16-20/h8,11-12,15-16,19,21-22H,3-7,9-10,13-14,17-18H2,1-2H3,(H,24,25)/t21-,22+/m0/s1
InChIKey QTMZUARRZBCITQ-FCHUYYIVSA-N
Mol Weight 438.5 g/mol
Molecular Formula C23H37NO2Se
Exact Mass 439.198951 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G69TTATDbLn
Name Carbamic acid, [1-butyl-2-(phenylseleno)hexyl]-, cyclohexyl ester, (R*,S*)-
Alternate Name(s) cyclohexyl (1S,2R)-1-butyl-2-(phenylselanyl)hexylcarbamate Erythro-cyclohexyl[1-butyl-2-(phenylseleno)hexyl]carbamate
CAS Registry Number 106672-45-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H37NO2Se
InChI InChI=1S/C23H37NO2Se/c1-3-5-17-21(24-23(25)26-19-13-9-7-10-14-19)22(18-6-4-2)27-20-15-11-8-12-16-20/h8,11-12,15-16,19,21-22H,3-7,9-10,13-14,17-18H2,1-2H3,(H,24,25)/t21-,22+/m0/s1
InChIKey QTMZUARRZBCITQ-FCHUYYIVSA-N
Molecular Weight 438.526 g/mol
SMILES N(C(OC1CCCCC1)=O)[C@]([C@]([Se]c1ccccc1)(CCCC)[H])(CCCC)[H]
SPLASH splash10-0a4i-0902000000-a0d70c77f6c8f2bbc70f
Source of Spectrum KC-1990-2422-31
Wiley ID 1384414