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{t-3-Iodo-c-4-[(2''-nitrophenyl)-1H-1',2',3'-triazol-1'-yl]-r-1-cyclopentyl}-methanol

View entire compound with spectra: 1 MS (GC)

{t-3-Iodo-c-4-[(2''-nitrophenyl)-1H-1',2',3'-triazol-1'-yl]-r-1-cyclopentyl}-methanol
SpectraBase Compound ID zhdTcjMS9j
InChI InChI=1S/C14H15IN4O3/c15-11-5-9(8-20)6-14(11)18-7-12(16-17-18)10-3-1-2-4-13(10)19(21)22/h1-4,7,9,11,14,20H,5-6,8H2/t9-,11-,14-/m0/s1
InChIKey BBKAZNJEFKDDIM-CHIMOYNISA-N
Mol Weight 414.2 g/mol
Molecular Formula C14H15IN4O3
Exact Mass 414.018885 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gai0px4MEl2
Name {t-3-Iodo-c-4-[(2''-nitrophenyl)-1H-1',2',3'-triazol-1'-yl]-r-1-cyclopentyl}-methanol
Alternate Name(s) {t-3-Iodo-c-4-[4'-(2''-nitrophenyl)-1'H-1',2',3'-triazol-1'-yl]-r-1-cyclopentyl}-methanol ((1R,3S,4S)-3-iodo-4-(4-(2-nitrophenyl)-1H-1,2,3-triazol-1-yl)cyclopentyl)methanol
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Formula C14H15IN4O3
InChI InChI=1S/C14H15IN4O3/c15-11-5-9(8-20)6-14(11)18-7-12(16-17-18)10-3-1-2-4-13(10)19(21)22/h1-4,7,9,11,14,20H,5-6,8H2/t9-,11-,14-/m0/s1
InChIKey BBKAZNJEFKDDIM-CHIMOYNISA-N
Molecular Weight 414.203 g/mol
SMILES OC[C@@]1(C[C@]([n]2nnc(c2)-c2c(N(=O)=O)cccc2)([C@](C1)(I)[H])[H])[H]
SPLASH splash10-004i-9100000000-92c16c886c0036f4df4b
Source of Spectrum F5-5-3810-26a
Wiley ID 1733316