| SpectraBase Spectrum ID |
EDRixw2dDoH |
| Name |
Allobarbital |
| CAS Registry Number |
52-43-7 |
| Classification |
Hypnotic |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
208.084792251 u |
| Formula |
C10H12N2O3 |
| InChI |
InChI=1S/C10H12N2O3/c1-3-5-10(6-4-2)7(13)11-9(15)12-8(10)14/h3-4H,1-2,5-6H2,(H2,11,12,13,14,15) |
| InChIKey |
FDQGNLOWMMVRQL-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
208.217 g/mol |
| SMILES |
C(C=C)C1(CC=C)C(=O)NC(NC1=O)=O |
| SPLASH |
splash10-014i-8900000000-1aeb58d1a4d39260c4f1 |
| 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. |
| Sample Preparation Procedure |
Detected: G P U+UHYAC |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_16 |
