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N-(1-chloro-1,1-difluorooct-3-yn-2-ylidene)-2-iodoaniline
SpectraBase Compound ID xOGwUuAVlH
InChI InChI=1S/C14H13ClF2IN/c1-2-3-4-5-10-13(14(15,16)17)19-12-9-7-6-8-11(12)18/h6-9H,2-4H2,1H3/b19-13-
InChIKey VDYGTCOJUXVMDT-UYRXBGFRSA-N
Mol Weight 395.62 g/mol
Molecular Formula C14H13ClF2IN
Exact Mass 394.974928 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J9xHT1JlJBm
Name N-(1-chloro-1,1-difluorooct-3-yn-2-ylidene)-2-iodoaniline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H13ClF2IN
InChI InChI=1S/C14H13ClF2IN/c1-2-3-4-5-10-13(14(15,16)17)19-12-9-7-6-8-11(12)18/h6-9H,2-4H2,1H3/b19-13-
InChIKey VDYGTCOJUXVMDT-UYRXBGFRSA-N
Literature Reference DOI 10.1002/adsc.200900875
Molecular Weight 395.619 g/mol
SMILES c1(\N=C/(C(F)(F)Cl)C#CCCCC)c(cccc1)I
SPLASH splash10-03di-0019000000-52a29094e014ab4c071c
Source of Spectrum ASC-352-1296/SM9-1o
Synonyms (Z)-N-(1-chloro-1,1-difluorooct-3-yn-2-ylidene)-2-iodoaniline
Wiley ID 1764473