| SpectraBase Spectrum ID |
L6RMoEwG2Fg |
| Name |
2C-P artifact (deamino-) |
| Collision Gas |
N2 |
| Comments |
FTMS + p ESI d Full ms2 [email protected] [50.00-230.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C13H18O2 |
| InChI |
InChI=1S/C12H16O2/c1-4-6-10-7-11(13)9(5-2)8-12(10)14-3/h7-8H,2,4-6H2,1,3H3/p+1 |
| InChIKey |
VINHUUSJOUKNFC-UHFFFAOYSA-O |
| Inlet Type |
UHPLC |
| Instrument Name |
Thermo Fisher Q Exactive Orbitrap |
| Ion Polarity |
P |
| Ionization Type |
HESI |
| Precursor Ion |
[M+H]+ |
| SMILES |
OC1=CC(CCC)=C(C=C1C[CH2+])OC |
| 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 |
