| SpectraBase Spectrum ID |
1aLYawSTKzu |
| Name |
Quinine-M (HO-) isomer-2 |
| Collision Gas |
N2 |
| Comments |
FTMS + p ESI d Full ms2 [email protected] [50.00-365.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C20H24N2O3 |
| InChI |
InChI=1S/C20H24N2O3/c1-3-14-12-7-9-22(20(14)24)18(10-12)19(23)15-6-8-21-17-5-4-13(25-2)11-16(15)17/h3-6,8,11-12,14,18-20,23-24H,1,7,9-10H2,2H3/t12-,14-,18?,19?,20+/m1/s1 |
| InChIKey |
ZPMAZSYGOOJJMP-UHFFFAOYSA-N |
| Inlet Type |
UHPLC |
| Instrument Name |
Thermo Fisher Q Exactive Orbitrap |
| Ion Polarity |
P |
| Ionization Type |
HESI |
| Precursor Ion |
[M+H]+ |
| SMILES |
O[C@@]1(N2CC[C@](CC2C(C2=CC=NC3=CC=C(C=C23)OC)O)([C@]1(C=C)[H])[H])[H] |
| Sample Comments |
The MMHW Reference Handbook is attached to Record #1, under the Attachments tab. Refer to this reference for the sample preparation procedure and abbreviations, as well as other relevant information pertaining to this database. |
| Selected Ion Charge |
1 |
| Source of Spectrum |
Maurer/Meyer/Helfer/Weber c/o Saarland University Homburg/Saar |
| Spectrum Type |
ms2 |
| Technique |
HCD |
