| SpectraBase Spectrum ID |
J2uMR3zPS8a |
| Name |
5,6-Ethylenedioxy-N,N-diallyl-tryptamine ## |
| Collision Gas |
N2 |
| Comments |
FTMS + p ESI d Full ms2 [email protected] [50.00-325.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C18H22N2O2 |
| InChI |
InChI=1S/C18H22N2O2/c1-3-6-20(7-4-2)8-5-14-13-19-16-12-18-17(11-15(14)16)21-9-10-22-18/h3-4,11-13,19H,1-2,5-10H2 |
| InChIKey |
PXZQHIHLMRONDP-UHFFFAOYSA-N |
| Inlet Type |
UHPLC |
| Instrument Name |
Thermo Fisher Q Exactive Orbitrap |
| Ion Polarity |
P |
| Ionization Type |
HESI |
| Precursor Ion |
[M+H]+ |
| SMILES |
N1C=C(C=2C1=CC1=C(C2)OCCO1)CCN(CC=C)CC=C |
| 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 |
