| SpectraBase Spectrum ID |
K0EILniLLqi |
| Name |
RCS-04 C4 derivative found in pure substance-M (HO-indole) MS2 |
| Comments |
F: ITMS + c ESI d w Full ms2 324.10 |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C20H21NO3 |
| InChI |
InChI=1S/C20H21NO3/c1-3-4-11-21-13-18(17-10-7-15(22)12-19(17)21)20(23)14-5-8-16(24-2)9-6-14/h5-10,12-13,22H,3-4,11H2,1-2H3 |
| InChIKey |
UXAVVGHUTNCJCE-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
OC=1C=C2N(CCCC)C=C(C2=CC1)C(C1=CC=C(C=C1)OC)=O |
| Sample Comments |
The MWW Reference Handbook and associated table are attached to Record #1, under the Attachments tab. Refer to these references for the sample preparation procedure and abbreviations, as well as other relevant information pertaining to this database. |
| Sample Description |
Analyte Type: Metabolite |
| Source of Spectrum |
Maurer/Wissenbach/Weber, Saarland University |
| Spectrum Type |
ms2 |
| Technique |
ITMS |
