| SpectraBase Spectrum ID |
AlMkuxwn09z |
| Name |
Isocitric acid 3ME |
| Classification |
Chemical |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
234.073952784 u |
| Formula |
C9H14O7 |
| InChI |
InChI=1S/C9H14O7/c1-14-6(10)4-5(8(12)15-2)7(11)9(13)16-3/h5,7,11H,4H2,1-3H3 |
| InChIKey |
HRMWDPSXPUUMOQ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
234.204 g/mol |
| SMILES |
C(C(OC)=O)(O)C(CC(=O)OC)C(OC)=O |
| SPLASH |
splash10-0aou-5900000000-bdf615dad6f8159d4316 |
| 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. |
| 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_6453 |
