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{t-3-Iodo-c-4-[5'-iodo-4'-(3''-thienyl)-1'H-1',2',3'-triazol-1'-yl]-r-1-cyclopentyl}-methanol
SpectraBase Compound ID EVrSyLxFerS
InChI InChI=1S/C12H13I2N3OS/c13-9-3-7(5-18)4-10(9)17-12(14)11(15-16-17)8-1-2-19-6-8/h1-2,6-7,9-10,18H,3-5H2/t7-,9-,10-/m0/s1
InChIKey JMHFPHNOTUVKCJ-HGNGGELXSA-N
Mol Weight 501.12 g/mol
Molecular Formula C12H13I2N3OS
Exact Mass 500.886873 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 23Fm7mAUxQi
Name {t-3-Iodo-c-4-[5'-iodo-4'-(3''-thienyl)-1'H-1',2',3'-triazol-1'-yl]-r-1-cyclopentyl}-methanol
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Formula C12H13I2N3OS
InChI InChI=1S/C12H13I2N3OS/c13-9-3-7(5-18)4-10(9)17-12(14)11(15-16-17)8-1-2-19-6-8/h1-2,6-7,9-10,18H,3-5H2/t7-,9-,10-/m0/s1
InChIKey JMHFPHNOTUVKCJ-HGNGGELXSA-N
Molecular Weight 501.125 g/mol
SMILES OC[C@@]1(C[C@]([n]2c(c(-c3cscc3)nn2)I)([C@](C1)(I)[H])[H])[H]
SPLASH splash10-004i-9010000000-7e60d4541e255dad6885
Source of Spectrum F5-5-3811-30b
Synonyms {t-3-Iodo-c-4-[5'-iodo-4'-(3''-thienyl)-1H-1',2',3'-triazol-1'-yl]-r-1-cyclopentyl}-methanol ((1R,3S,4S)-3-iodo-4-(5-iodo-4-(thiophen-3-yl)-1H-1,2,3-triazol-1-yl)cyclopentyl)methanol
Wiley ID 1733310