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(2S,4S)-2,6,6-Trimethyl-2-oxo-4-pentadecyl-1,3-dioxa-6-aza-2-phosphacyclooctyl Bromide

View entire compound with spectra: 1 MS (GC)

(2S,4S)-2,6,6-Trimethyl-2-oxo-4-pentadecyl-1,3-dioxa-6-aza-2-phosphacyclooctyl Bromide
SpectraBase Compound ID Lpfqd9MiSO8
InChI InChI=1S/C22H47NO3P.BrH/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-21-23(2,3)19-20-25-27(4,24)26-22;/h22H,5-21H2,1-4H3;1H/q+1;/p-1/t22-,27?;/m0./s1
InChIKey JMQIBMOTGMRNKZ-GLTBACFOSA-M
Mol Weight 484.5 g/mol
Molecular Formula C22H47BrNO3P
Exact Mass 483.247694 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BFpXl8XoPro
Name (2S,4S)-2,6,6-Trimethyl-2-oxo-4-pentadecyl-1,3-dioxa-6-aza-2-phosphacyclooctyl Bromide
Alternate Name(s) (4S)-2,6,6-trimethyl-4-pentadecyltetrahydro-4H-1,3,6,2-dioxazaphosphocin-6-ium 2-oxide bromide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H47BrNO3P
InChI InChI=1S/C22H47NO3P.BrH/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-21-23(2,3)19-20-25-27(4,24)26-22;/h22H,5-21H2,1-4H3;1H/q+1;/p-1/t22-,27?;/m0./s1
InChIKey JMQIBMOTGMRNKZ-GLTBACFOSA-M
Molecular Weight 484.500 g/mol
SMILES [Br-].[C@@]1(OP(OCC[N+](C1)(C)C)(=O)C)(CCCCCCCCCCCCCCC)[H]
SPLASH splash10-05i1-9110000000-35cd46ec24a04846e406
Source of Spectrum J-61-9384-2
Wiley ID 1395787