| SpectraBase Spectrum ID |
D44DbaIDihb |
| Name |
2C-T-7-M (HO-acetyl-) ## |
| Collision Gas |
N2 |
| Comments |
FTMS + p ESI d Full ms2 [email protected] [50.00-340.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C15H23NO4S |
| InChI |
InChI=1S/C15H23NO4S/c1-11(18)16-6-5-12-9-14(20-3)15(10-13(12)19-2)21-8-4-7-17/h9-10,17H,4-8H2,1-3H3,(H,16,18) |
| InChIKey |
AEIPOAUPWYXZBN-UHFFFAOYSA-N |
| Inlet Type |
UHPLC |
| Instrument Name |
Thermo Fisher Q Exactive Orbitrap |
| Ion Polarity |
P |
| Ionization Type |
HESI |
| Precursor Ion |
[M+H]+ |
| SMILES |
OCCCSC1=C(C=C(CCNC(C)=O)C(=C1)OC)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 |
