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2-Chloro-4,5-difluoro-benzoic acid 2-methoxy-4-[(1H-tetrazol-5-yl)-hydrazonomethyl]-phenyl ester

View entire compound with spectra: 1 NMR, and 1 MS (GC)

2-Chloro-4,5-difluoro-benzoic acid 2-methoxy-4-[(1H-tetrazol-5-yl)-hydrazonomethyl]-phenyl ester
SpectraBase Compound ID 4axLi96r6qj
InChI InChI=1S/C16H11ClF2N6O3/c1-27-14-4-8(7-20-21-16-22-24-25-23-16)2-3-13(14)28-15(26)9-5-11(18)12(19)6-10(9)17/h2-7H,1H3,(H2,21,22,23,24,25)/b20-7+
InChIKey JAMCRZRCLOCYEC-IFRROFPPSA-N
Mol Weight 408.75 g/mol
Molecular Formula C16H11ClF2N6O3
Exact Mass 408.054922 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7ZDtpyrjyne
Name 2-Chloro-4,5-difluoro-benzoic acid 2-methoxy-4-[(1H-tetrazol-5-yl)-hydrazonomethyl]-phenyl ester
Alternate Name(s) 2-Chloro-4,5-difluoro-benzoic acid[2-methoxy-4-[(E)-(2H-tetrazol-5-ylhydrazono)methyl]phenyl]ester 2-Chloro-4,5-difluorobenzoic acid[2-methoxy-4-[(E)-(2H-tetrazol-5-ylhydrazinylidene)methyl]phenyl]ester 2-Methoxy-4-[(1H-tetraazol-5-ylhydrazono)methyl]phenyl 2-chloro-4,5-difluorobenzoate 2-Methoxy-4-[(E)-(1H-tetraazol-5-ylhydrazono)methyl]phenyl 2-chloro-4,5-difluorobenzoate [2-methoxy-4-[(E)-(2H-1,2,3,4-tetrazol-5-ylhydrazinylidene)methyl]phenyl]2-chloranyl-4,5-bis(fluoranyl)benzoate [2-methoxy-4-[(E)-(2H-tetrazol-5-ylhydrazinylidene)methyl]phenyl]2-chloro-4,5-difluorobenzoate [2-methoxy-4-[(E)-(2H-tetrazol-5-ylhydrazono)methyl]phenyl]2-chloro-4,5-difluoro-benzoate 2-Chloro-4,5-difluorobenzoic acid [2-methoxy-4-[(E)-(2H-tetrazol-5-ylhydrazinylidene)methyl]phenyl] ester [2-methoxy-4-[(E)-(2H-tetrazol-5-ylhydrazinylidene)methyl]phenyl] 2-chloro-4,5-difluorobenzoate [2-methoxy-4-[(E)-(2H-tetrazol-5-ylhydrazono)methyl]phenyl] 2-chloro-4,5-difluoro-benzoate [2-methoxy-4-[(E)-(2H-1,2,3,4-tetrazol-5-ylhydrazinylidene)methyl]phenyl] 2-chloranyl-4,5-bis(fluoranyl)benzoate
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Formula C16H11ClF2N6O3
InChI InChI=1S/C16H11ClF2N6O3/c1-27-14-4-8(7-20-21-16-22-24-25-23-16)2-3-13(14)28-15(26)9-5-11(18)12(19)6-10(9)17/h2-7H,1H3,(H2,21,22,23,24,25)/b20-7+
InChIKey JAMCRZRCLOCYEC-IFRROFPPSA-N
Molecular Weight 408.753 g/mol
SMILES [nH]1nnnc1N\N=C\c1cc(OC)c(OC(c2c(cc(c(c2)F)F)Cl)=O)cc1
SPLASH splash10-004i-2900000000-ff094cbc58a844d48b7e
Wiley ID 1447246