Vitas-M small molecule compound
tricyclo[3.3.1.1~3,7~]dec-1-ylmethyl 4-nitrobenzoate
Catalog ID
STK735962
SMILES O=C(c1ccc(cc1)[N+](=O)[O-])OCC12CC3CC(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 C18H21NO4 MW 315.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21NO4/c20-17(15-1-3-16(4-2-15)19(21)22)23-11-18-8-12-5-13(9-18)7-14(6-12)10-18/h1-4,12-14H,5-11H2InChIKey
GUHVKAPDQTZCNO-UHFFFAOYSA-NSynonyms
1ADAMANTYLMETHYL4NITROBENZOATE
4NITROBENZOICACID1ADAMANTYLMETHYLESTER
ADAMANTAN1YLMETHYL4NITROBENZOATE
ADAMANTANYLMETHYL4NITROBENZOATE
C1C2CC3CC1CC(C2)(C3)COC(=O)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC18H21NO4c2017(151316(4215)19(21)22)231118812513(918)714(612)1018h141214H511H2
MFCD05857296
O=C(c1ccc(cc1)(N+)(=O)(O))OCC12CC3CC(C2)CC(C1)C3
tricyclo(3311~37~)dec1ylmethyl4nitrobenzoate
ZINC000004698383
ZINC04698383
ZINC4698383
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