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2-[5-[4-(2-chlorobenzyl)oxyphenyl]tetrazol-2-yl]-N-(1-ethyl-1-methyl-prop-2-ynyl)acetamide
SpectraBase Compound ID KzvF24HnLp
InChI InChI=1S/C22H22ClN5O2/c1-4-22(3,5-2)24-20(29)14-28-26-21(25-27-28)16-10-12-18(13-11-16)30-15-17-8-6-7-9-19(17)23/h1,6-13H,5,14-15H2,2-3H3,(H,24,29)
InChIKey MKRBWEFKMLDVDU-UHFFFAOYSA-N
Mol Weight 423.9 g/mol
Molecular Formula C22H22ClN5O2
Exact Mass 423.146203 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8BVtVVfoi1R
Name 2-[5-[4-(2-chlorobenzyl)oxyphenyl]tetrazol-2-yl]-N-(1-ethyl-1-methyl-prop-2-ynyl)acetamide
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Formula C22H22ClN5O2
InChI InChI=1S/C22H22ClN5O2/c1-4-22(3,5-2)24-20(29)14-28-26-21(25-27-28)16-10-12-18(13-11-16)30-15-17-8-6-7-9-19(17)23/h1,6-13H,5,14-15H2,2-3H3,(H,24,29)
InChIKey MKRBWEFKMLDVDU-UHFFFAOYSA-N
Molecular Weight 423.904 g/mol
SMILES N(C(C)(CC)C#C)C(=O)C[n]1nc(-c2ccc(OCc3ccccc3Cl)cc2)nn1
SPLASH splash10-004i-7920000000-52b8cf5b04a54f24eb91
Synonyms 2-[5-[4-[(2-chlorophenyl)methoxy]phenyl]-1,2,3,4-tetrazol-2-yl]-N-(3-methylpent-1-yn-3-yl)ethanamide 2-[5-[4-[(2-chlorophenyl)methoxy]phenyl]-2-tetrazolyl]-N-(3-methylpent-1-yn-3-yl)acetamide 2-[5-[4-[(2-chlorophenyl)methoxy]phenyl]tetrazol-2-yl]-N-(1-ethyl-1-methyl-prop-2-ynyl)acetamide 2-[5-[4-[(2-chlorophenyl)methoxy]phenyl]tetrazol-2-yl]-N-(3-methylpent-1-yn-3-yl)acetamide
Wiley ID 1512395