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12,13-dibromo[2]paracyclo[2](2,5)thiophenophane
SpectraBase Compound ID BVjUGB8JpHK
InChI InChI=1S/C14H12Br2S/c15-13-11-6-4-9-2-1-3-10(8-9)5-7-12(17-11)14(13)16/h1-3,8H,4-7H2
InChIKey VVFKOFJJLOOAIN-UHFFFAOYSA-N
Mol Weight 372.12 g/mol
Molecular Formula C14H12Br2S
Exact Mass 369.902648 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GsTvukivSkh
Name 12,13-dibromo[2]paracyclo[2](2,5)thiophenophane
Alternate Name(s) 5,6-Dibromo-15-thiatricyclo[8.3.1.1(4,7)]pentadeca-1(14),4,6,10,12-pentaene
CAS Registry Number 132564-52-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12Br2S
InChI InChI=1S/C14H12Br2S/c15-13-11-6-4-9-2-1-3-10(8-9)5-7-12(17-11)14(13)16/h1-3,8H,4-7H2
InChIKey VVFKOFJJLOOAIN-UHFFFAOYSA-N
Molecular Weight 372.118 g/mol
SMILES c1(c(c2CCc3cccc(c3)CCc1s2)Br)Br
SPLASH splash10-0udi-0901000000-dc617ab1c129ae305318
Source of Spectrum K-124-1408-14
Wiley ID 1353955