| SpectraBase Spectrum ID |
CQMlXDnFNKQ |
| Name |
Hexobarbital |
| CAS Registry Number |
56-29-1 |
| Classification |
Anesthetic |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
236.116092380 u |
| Formula |
C12H16N2O3 |
| InChI |
InChI=1S/C12H16N2O3/c1-12(8-6-4-3-5-7-8)9(15)13-11(17)14(2)10(12)16/h6H,3-5,7H2,1-2H3,(H,13,15,17) |
| InChIKey |
UYXAWHWODHRRMR-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
236.271 g/mol |
| SMILES |
C1(NC(C(C(N1C)=O)(C=1CCCCC1)C)=O)=O |
| SPLASH |
splash10-05ir-9530000000-4de021f01085b521d6df |
| 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: P G 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_809 |
