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(Z)-1-chloranyl-4-(dimethylamino)-3-(1-phenyl-1,2,3,4-tetrazol-5-yl)but-3-en-2-one
SpectraBase Compound ID HKEAOtGmw5H
InChI InChI=1S/C13H14ClN5O/c1-18(2)9-11(12(20)8-14)13-15-16-17-19(13)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3/b11-9+
InChIKey URFNLKBOOGRJAN-PKNBQFBNSA-N
Mol Weight 291.74 g/mol
Molecular Formula C13H14ClN5O
Exact Mass 291.088688 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9bvZod85okI
Name (Z)-1-chloranyl-4-(dimethylamino)-3-(1-phenyl-1,2,3,4-tetrazol-5-yl)but-3-en-2-one
Alternate Name(s) (Z)-1-chloro-4-(dimethylamino)-3-(1-phenyl-5-tetrazolyl)-3-buten-2-one (Z)-1-chloro-4-(dimethylamino)-3-(1-phenyltetrazol-5-yl)but-3-en-2-one
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Formula C13H14ClN5O
InChI InChI=1S/C13H14ClN5O/c1-18(2)9-11(12(20)8-14)13-15-16-17-19(13)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3/b11-9+
InChIKey URFNLKBOOGRJAN-PKNBQFBNSA-N
Molecular Weight 291.742 g/mol
SMILES c1([n](nnn1)-c1ccccc1)\C(=C\N(C)C)C(=O)CCl
SPLASH splash10-001l-9220000000-4764dec4892459a94e9f
Source of Spectrum Y-33-818-23
Wiley ID 1294378