SpectraBase Spectrum ID |
3DKuDo5r65g |
Name |
RCS-04-M (dihydro-) MS2 |
Comments |
F: ITMS + c ESI d w Full ms2 324.10 |
Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
Formula |
C21H25NO2 |
InChI |
InChI=1S/C21H25NO2/c1-3-4-7-14-22-15-19(18-8-5-6-9-20(18)22)21(23)16-10-12-17(24-2)13-11-16/h5-6,8-13,15,21,23H,3-4,7,14H2,1-2H3 |
InChIKey |
YJENASQSIHOJRT-UHFFFAOYSA-N |
Ion Polarity |
P |
Ionization Type |
ESI |
SMILES |
OC(C=1C=2C(N(CCCCC)C1)=CC=CC2)C1=CC=C(C=C1)OC |
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 |