| SpectraBase Spectrum ID |
GJaZJaaWR7D |
| Name |
Heptabarbital-M (HO-) -H2O |
| Classification |
Hypnotic |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
248.116092380 u |
| Formula |
C13H16N2O3 |
| InChI |
InChI=1S/C13H16N2O3/c1-2-13(9-7-5-3-4-6-8-9)10(16)14-12(18)15-11(13)17/h3,5,7H,2,4,6,8H2,1H3,(H2,14,15,16,17,18) |
| InChIKey |
JTCHEKGPUCRFSB-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
248.282 g/mol |
| SMILES |
C(C)C1(C(=O)NC(NC1=O)=O)C=1CCCC=CC1 |
| SPLASH |
splash10-0006-9410000000-ae915112c5a0efde2066 |
| 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: 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_805 |
