An Analytical Reference Standard
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Parent Compound(s)
35059ADB-FUBIATA
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2-(1-(4-Fluorobenzyl)-1H-indol-3-yl)acetic Acid

Item No. 36015

Product Insert (PDF)Safety Data Sheet (SDS) (PDF)
Technical Information
Formal Name
1-[(4-fluorophenyl)methyl]-1H-indole-3-acetic acid
CAS Number
176204-51-6
Molecular Formula
C17H14FNO2
Formula Weight
283.3
Purity
≥98%
Formulation
A solid
λmax
222 nm
SMILES
FC(C=C1)=CC=C1CN(C2=C3C=CC=C2)C=C3CC(O)=O
InChi Code
InChI=1S/C17H14FNO2/c18-14-7-5-12(6-8-14)10-19-11-13(9-17(20)21)15-3-1-2-4-16(15)19/h1-8,11H,9-10H2,(H,20,21)
InChi Key
MSECUWYFWKAGLD-UHFFFAOYSA-N
Shipping & Storage Information
Storage
-20°C
Shipping
Room temperature in continental US; may vary elsewhere
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    Product Description

    2-(1-(4-Fluorobenzyl)-1H-indol-3-yl)acetic acid (Item No. 36015) is an analytical reference standard that is structurally similar to known synthetic cannabinoids. 2-(1-(4-Fluorobenzyl)-1H-indol-3-yl)acetic acid is a potential metabolite of ADB-FUBIATA (Item No. 35059) based on the published metabolism of 5-fluoro ABICA (Item No. 9001555).1 At the time 2-(1-(4-fluorobenzyl)-1H-indol-3-yl)acetic acid (Item No. 36015) was made available for purchase, specific metabolism data had not been published. Contact us if updated information on this molecule is now available. This product is intended for research and forensic applications.

    WARNING This product is not for human or veterinary use.

    References & Product Citations
    Product Description References

    1. Franz, F., Jechle, H., Wilde, M., et al. Structure-metabolism relationships of valine and tert-leucine-derived synthetic cannabinoid receptor agonists: A systematic comparison of the in vitro phase I metabolism using pooled human liver microsomes and high-resolution mass spectrometry. Forensic Toxicol. 37, 316-329 (2019).