| SpectraBase Spectrum ID |
6zy0tHNI67q |
| Name |
Indole propionic acid ME |
| CAS Registry Number |
5548-09-4 |
| Classification |
Biomolecule |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
203.094628661 u |
| Formula |
C12H13NO2 |
| InChI |
InChI=1S/C12H13NO2/c1-15-12(14)7-6-9-8-13-11-5-3-2-4-10(9)11/h2-5,8,13H,6-7H2,1H3 |
| InChIKey |
BAYIDMGOQRXHBC-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
203.241 g/mol |
| SMILES |
c1cc2c(c[nH]c2cc1)CCC(OC)=O |
| SPLASH |
splash10-001i-2900000000-dd17518d20b1ca26d68d |
| 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 |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Synonyms |
Indole propionic acid ME |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_6375 |
