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(Z)-1,1,1-trichloro-3-(1-phenyl-5-tetrazolyl)-4-(1-pyrrolidinyl)-3-buten-2-one
SpectraBase Compound ID JQQRcuboY1o
InChI InChI=1S/C15H14Cl3N5O/c16-15(17,18)13(24)12(10-22-8-4-5-9-22)14-19-20-21-23(14)11-6-2-1-3-7-11/h1-3,6-7,10H,4-5,8-9H2/b12-10+
InChIKey KGSHOHPGJMNHLG-ZRDIBKRKSA-N
Mol Weight 386.67 g/mol
Molecular Formula C15H14Cl3N5O
Exact Mass 385.026393 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7mBrHSzh8iC
Name (Z)-1,1,1-trichloro-3-(1-phenyl-5-tetrazolyl)-4-(1-pyrrolidinyl)-3-buten-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H14Cl3N5O
InChI InChI=1S/C15H14Cl3N5O/c16-15(17,18)13(24)12(10-22-8-4-5-9-22)14-19-20-21-23(14)11-6-2-1-3-7-11/h1-3,6-7,10H,4-5,8-9H2/b12-10+
InChIKey KGSHOHPGJMNHLG-ZRDIBKRKSA-N
Molecular Weight 386.670 g/mol
SMILES c1(\C(C(C(Cl)(Cl)Cl)=O)=C\N2CCCC2)[n](nnn1)-c1ccccc1
SPLASH splash10-0a4i-9510000000-09ab560e978305f7751c
Synonyms (Z)-1,1,1-trichloro-3-(1-phenyltetrazol-5-yl)-4-pyrrolidin-1-yl-but-3-en-2-one (Z)-1,1,1-trichloro-3-(1-phenyltetrazol-5-yl)-4-pyrrolidino-but-3-en-2-one (Z)-1,1,1-tris(chloranyl)-3-(1-phenyl-1,2,3,4-tetrazol-5-yl)-4-pyrrolidin-1-yl-but-3-en-2-one
Wiley ID 1452387