Vitas-M small molecule compound

[1-(4-fluorophenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]acetonitrile

Catalog ID
STL349549
SMILES N#CCN1CCC2(C(C1c1ccc(cc1)F)CCCC2)O

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C17H21FN2O MW 288.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21FN2O/c18-14-6-4-13(5-7-14)16-15-3-1-2-8-17(15,21)9-11-20(16)12-10-19/h4-7,15-16,21H,1-3,8-9,11-12H2
InChIKey
KWBQFDMCWGGSEX-UHFFFAOYSA-N
Synonyms
1009232-25-0
((1S4AR8AR)1(4FLUOROPHENYL)4AHYDROXYOCTAHYDROISOQUINOLIN2(1H)YL)ACETONITRILE
(1(4fluorophenyl)4ahydroxyoctahydroisoquinolin2(1H)yl)acetonitrile
1009232250
2(1(4fluorophenyl)4ahydroxy13456788aoctahydroisoquinolin2yl)acetonitrile
2(1(4fluorophenyl)4ahydroxyoctahydroisoquinolin2(1H)yl)acetonitrile
C1CCC2(CCN(C(C2C1)C3=CC=C(C=C3)F)CC#N)O
InChI=1SC17H21FN2Oc18146413(5714)1615312817(1521)91120(16)121019h47151621H13891112H2
MFCD04184191
ZINC000005997086
ZINC000230067318

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Available files

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