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{t-3-Iodo-c-4-[4'-(2''-pyridinyl)-1'H-1',2',3'-triazol-1'-yl]-r-1-cyclopentyl}-methanol
SpectraBase Compound ID GxxVfg99tea
InChI InChI=1S/C13H15IN4O/c14-10-5-9(8-19)6-13(10)18-7-12(16-17-18)11-3-1-2-4-15-11/h1-4,7,9-10,13,19H,5-6,8H2/t9-,10-,13-/m0/s1
InChIKey RYHPTSYVMLHMHR-KWBADKCTSA-N
Mol Weight 370.19 g/mol
Molecular Formula C13H15IN4O
Exact Mass 370.029056 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LxTLLua9fTQ
Name {t-3-Iodo-c-4-[4'-(2''-pyridinyl)-1'H-1',2',3'-triazol-1'-yl]-r-1-cyclopentyl}-methanol
Alternate Name(s) {t-3-Iodo-c-4-[4'-(2''-pyridinyl)-1H-1',2',3'-triazol-1'-yl]-r-1-cyclopentyl}-methanol ((1R,3S,4S)-3-iodo-4-(4-(pyridin-2-yl)-1H-1,2,3-triazol-1-yl)cyclopentyl)methanol
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Formula C13H15IN4O
InChI InChI=1S/C13H15IN4O/c14-10-5-9(8-19)6-13(10)18-7-12(16-17-18)11-3-1-2-4-15-11/h1-4,7,9-10,13,19H,5-6,8H2/t9-,10-,13-/m0/s1
InChIKey RYHPTSYVMLHMHR-KWBADKCTSA-N
Molecular Weight 370.194 g/mol
SMILES OC[C@@]1(C[C@]([n]2nnc(c2)-c2ncccc2)([C@](C1)(I)[H])[H])[H]
SPLASH splash10-014i-4911000000-b5d6eee3cc4bb2086a2a
Source of Spectrum F5-5-3812-31a
Wiley ID 1733309