Vitas-M small molecule compound

3-(tricyclo[3.3.1.1~3,7~]dec-1-yl)prop-2-ynoic acid

Catalog ID
STK675123
SMILES OC(=O)C#CC12CC3CC(C2)CC(C1)C3

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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 C13H16O2 MW 204.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16O2/c14-12(15)1-2-13-6-9-3-10(7-13)5-11(4-9)8-13/h9-11H,3-8H2,(H,14,15)
InChIKey
NLHRGHCCCHUIHM-UHFFFAOYSA-N
Synonyms
106386-45-2
106386452
3(1ADAMANTYL)2PROPYNOICACID
3(1ADAMANTYL)PROP2YNOICACID
3(tricyclo(3311~37~)dec1yl)prop2ynoicacid
3ADAMANTANYLPROP2YNOICACID
C1C2CC3CC1CC(C2)(C3)C#CC(=O)O
InChI=1SC13H16O2c1412(15)121369310(713)511(49)813h911H38H2(H1415)
MFCD01831609
ZINC000000052494
ZINC52494

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.