| SpectraBase Spectrum ID |
7NRNi0PP28R |
| Name |
1,3-Butane diol phenylboronate |
| Classification |
Chemical |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
176.100859827 u |
| Formula |
C10H13BO2 |
| InChI |
InChI=1S/C10H13BO2/c1-9-7-8-12-11(13-9)10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3 |
| InChIKey |
ZWDKYUPKFUIRSJ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
176.022 g/mol |
| SMILES |
c1c(cccc1)B1OC(CCO1)C |
| SPLASH |
splash10-0w4i-3900000000-6459a6e9a5c72e9860c5 |
| Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Synonyms |
1,3-Butane diol phenylboronate |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_1901 |
