SpectraBase Spectrum ID |
DoqJ6xmU2Lo |
Name |
Serotonine 3AC |
Classification |
Neurotransmitter derivative |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
302.126657064 u |
Formula |
C16H18N2O4 |
InChI |
InChI=1S/C16H18N2O4/c1-10(19)17-7-6-13-9-18(11(2)20)16-5-4-14(8-15(13)16)22-12(3)21/h4-5,8-9H,6-7H2,1-3H3,(H,17,19) |
InChIKey |
XWHHPYQAUJDFKM-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
302.330 g/mol |
Nominal Mass |
302 u |
Quality |
954 |
Retention Index |
2740 |
SMILES |
C=12C(N(C=C2CCNC(=O)C)C(=O)C)=CC=C(C1)OC(=O)C |
SPLASH |
splash10-0udl-0690000000-72954ad2057ff360b27f |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
1-acetyl-3-(2-(acetylamino)ethyl)-1H-indol-5-yl acetate |
Technique |
GC/MS |
Wiley ID |
DD2024_005986 |