SpectraBase Spectrum ID |
DmRtt87ccnA |
Name |
Dibutoxymethanol |
CAS Registry Number |
54518-04-6 |
Classification |
Solvent |
Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
176.141244501 u |
Formula |
C9H20O3 |
InChI |
InChI=1S/C9H20O3/c1-3-5-7-11-9(10)12-8-6-4-2/h9-10H,3-8H2,1-2H3 |
InChIKey |
XJQDMYMQYMSZNX-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
176.256 g/mol |
Nominal Mass |
176 u |
Quality |
1000 |
Retention Index |
1211 |
SMILES |
OC(OCCCC)OCCCC |
SPLASH |
splash10-0a4r-9000000000-5e3665396e29c12ec4a3 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
dibutoxymethanol |
Technique |
GC/MS |
Wiley ID |
DD2024_032988 |