Vitas-M small molecule compound

(5-nitrospiro[1,3-dioxane-2,2'-tricyclo[3.3.1.1~3,7~]decan]-5-yl)methanol

Catalog ID
STK665127
SMILES OCC1(COC2(OC1)C1CC3CC2CC(C1)C3)[N+](=O)[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 C14H21NO5 MW 283.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H21NO5/c16-6-13(15(17)18)7-19-14(20-8-13)11-2-9-1-10(4-11)5-12(14)3-9/h9-12,16H,1-8H2
InChIKey
MJMLNBVLAOYJIS-UHFFFAOYSA-N
Synonyms

(5NITROSPIRO(13DIOXANE22ADAMANTANE)5YL)METHAN1OL
(5nitrospiro(13dioxane22adamantane)5yl)methanol
(5nitrospiro(13dioxane22tricyclo(3311~37~)decan)5yl)methanol
C1C2CC3CC1CC(C2)C34OCC(CO4)(CO)(N+)(=O)(O)
InChI=1SC14H21NO5c16613(15(17)18)71914(20813)1129110(411)512(14)39h91216H18H2
OCC1(COC2(OC1)C1CC3CC2CC(C1)C3)(N+)(=O)(O)
ZINC000012362968
ZINC12362968

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Available files

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