N-(1-Adamantylmethyl)-1-oxidopyridin-1-ium-3-carboxamide hydrochloride

CAS

61876-42-4

Catalog Number

ACM61876424

Category

Other Products

Molecular Weight

322.83 g/mol

Molecular Formula

C₁₇H₂₃ClN₂O₂

MSDS COA Spec Sheet

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Specification

IUPAC Name

[(2S,3aR,4R,6R,6aR)-4-(6-aminopurin-9-yl)-1',3',5'-trinitrospiro[3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxole-2,6'-cyclohexa-1,3-diene]-6-yl]methylphosphonohydrogenphosphate

Canonical SMILES

C1=C(C=C(C2(C1[N+](=O)[O-])OC3C(OC(C3O2)N4C=NC5=C4N=CN=C5N)COP(=O)(O)OP(=O)(O)O)[N+](=O)[O-])[N+](=O)[O-]

InChI Key

WYOHYTDXVJMKHS-QBEOYVKDSA-N

Boiling Point

567.7ºC at 760 mmHg

Flash Point

297.2ºC

Exact Mass

322.14500

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