| SpectraBase Spectrum ID |
8VGED4ydY6M |
| Name |
Isoniazid-M glycine conjugate |
| Classification |
Tuberculostatic |
| Comments |
Original RI info: ---- |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
180.053492123 u |
| Formula |
C8H8N2O3 |
| InChI |
InChI=1S/C8H8N2O3/c11-7(12)5-10-8(13)6-1-3-9-4-2-6/h1-4H,5H2,(H,10,13)(H,11,12) |
| InChIKey |
HKCLSDCBERVTCT-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
180.163 g/mol |
| SMILES |
c1cnccc1C(NCC(O)=O)=O |
| SPLASH |
splash10-05o9-5900000000-e0aa5b4a98740e3e4aa1 |
| 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 |
| 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_1047 |
