SpectraBase Spectrum ID |
2lguIbQSPWy |
Name |
1-But-2-yl-5-fluoroindole |
Classification |
Pharmaceutical drug intermediate |
Comments |
Spectrum verified by independent measurements in external laboratories |
Copyright |
Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
191.111027618 u |
Formula |
C12H14FN |
InChI |
InChI=1S/C12H14FN/c1-3-9(2)14-7-6-10-8-11(13)4-5-12(10)14/h4-9H,3H2,1-2H3 |
InChIKey |
VWRKLUBKHCJEII-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
191.249 g/mol |
Nominal Mass |
191 u |
Quality |
993 |
Retention Index |
1484 |
SMILES |
C=12C(C=CN2C(CC)C)=CC(=CC1)F |
SPLASH |
splash10-03di-1900000000-baa32d70f681530e05f3 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
Indole,1-but-2-yl-5-fluoro
1-But-2-yl-5-fluoro-1H-indole |
Technique |
GC/MS |
Wiley ID |
DD2024_017539 |