For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Triethyl(2-hydroxyethyl)ammonium bromide, xanthene-9-carboxylate
SpectraBase Compound ID 8s5BykiRhuN
InChI InChI=1S/C20H23NO3.C2H5Br/c1-3-21(4-2)13-14-23-20(22)19-15-9-5-7-11-17(15)24-18-12-8-6-10-16(18)19;1-2-3/h5-12,19H,3-4,13-14H2,1-2H3;2H2,1H3
InChIKey LURMJFWYJISWRL-UHFFFAOYSA-N
Mol Weight 434.37 g/mol
Molecular Formula C22H28BrNO3
Exact Mass 433.125257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Ez3P5mcImMg
Name Triethyl(2-hydroxyethyl)ammonium bromide, xanthene-9-carboxylate
Alternate Name(s) 2-(Diethylamino)ethyl 9H-xanthene-9-carboxylate 2-(diethylamino)ethyl 9H-xanthene-9-carboxylate compound with 1-bromoethane (1:1)
CAS Registry Number 122725-70-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H28BrNO3
InChI InChI=1S/C20H23NO3.C2H5Br/c1-3-21(4-2)13-14-23-20(22)19-15-9-5-7-11-17(15)24-18-12-8-6-10-16(18)19;1-2-3/h5-12,19H,3-4,13-14H2,1-2H3;2H2,1H3
InChIKey LURMJFWYJISWRL-UHFFFAOYSA-N
Molecular Weight 434.374 g/mol
SMILES CCBr.c1ccc2c(c1)Oc1c(C2C(=O)OCCN(CC)CC)cccc1
SPLASH splash10-001r-9500000000-68e3232aa3e848041b20
Wiley ID 1485522