For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
7,9,20-tribromononacyclo[11.7.1.16,18.0(1,16).0(2,11).0(3,8).0(4,19).0(8,17).0(10,15)]docosane
SpectraBase Compound ID 5HJAQ3AHoTW
InChI InChI=1S/C22H25Br3/c23-18-7-3-10-12-11(4-7)17-15-9-2-6-1-8-13(9)20(25)22(17,18)16(10)14(8)21(15,5-6)19(12)24/h6-20H,1-5H2
InChIKey UFSZBYZYJOFZHF-UHFFFAOYSA-N
Mol Weight 529.15 g/mol
Molecular Formula C22H25Br3
Exact Mass 525.95064 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 9tWD4Mtb0em
Name 7,9,20-tribromononacyclo[11.7.1.16,18.0(1,16).0(2,11).0(3,8).0(4,19).0(8,17).0(10,15)]docosane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H25Br3
InChI InChI=1S/C22H25Br3/c23-18-7-3-10-12-11(4-7)17-15-9-2-6-1-8-13(9)20(25)22(17,18)16(10)14(8)21(15,5-6)19(12)24/h6-20H,1-5H2
InChIKey UFSZBYZYJOFZHF-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Molecular Weight 529.154 g/mol
SMILES C12C3C(C45C6C2C27C(C5C5C(C6CC(C4Br)C5)C2Br)C3CC(C1)C7)Br
SPLASH splash10-004i-0032190000-811930ba25ffc5fa5b75
Source of Spectrum US7795468B2
Wiley ID 1874756