| SpectraBase Spectrum ID |
2ERxrm01M8 |
| Name |
Cyclobarbital-M (HO-) 3TMS |
| Classification |
Hypnotic |
| Comments |
Structure comment: Wiggly bond = unknown position of substituent |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
468.229587377 u |
| Formula |
C21H40N2O4Si3 |
| InChI |
InChI=1S/C21H40N2O4Si3/c1-11-21(16-12-14-17(15-13-16)27-30(8,9)10)18(24)22(28(2,3)4)20(26)23(19(21)25)29(5,6)7/h12,17H,11,13-15H2,1-10H3 |
| InChIKey |
JXLQVPCUGISHFU-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
468.816 g/mol |
| SMILES |
C1(N(C(=O)C(C(N1[Si](C)(C)C)=O)(C1=CCC(O[Si](C)(C)C)CC1)CC)[Si](C)(C)C)=O |
| SPLASH |
splash10-0g54-6415900000-ba92a783f4a062843bce |
| 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: UTMS |
| 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_4463 |
