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(S,E)-10-iodo-2,6-dimethylundeca-2,6-diene
SpectraBase Compound ID Cf4uVmOCa6z
InChI InChI=1S/C13H23I/c1-11(2)7-5-8-12(3)9-6-10-13(4)14/h7,9,13H,5-6,8,10H2,1-4H3/b12-9+/t13-/m0/s1
InChIKey QTXZERDRHSLZNE-SRXBQZRASA-N
Mol Weight 306.23 g/mol
Molecular Formula C13H23I
Exact Mass 306.084446 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID r1yUGxHBZf
Name (S,E)-10-iodo-2,6-dimethylundeca-2,6-diene
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H23I
InChI InChI=1S/C13H23I/c1-11(2)7-5-8-12(3)9-6-10-13(4)14/h7,9,13H,5-6,8,10H2,1-4H3/b12-9+/t13-/m0/s1
InChIKey QTXZERDRHSLZNE-SRXBQZRASA-N
Instrument Name FINNIGAN MAT 95Q
Ionization Type EI
Literature Reference DOI 10.1002/chem.202002297
Molecular Weight 306.231 g/mol
Optical Rotation [a]D20 = +37.6 (c = 1.0, CHCl3)
Reported Formula C13H23I
SMILES CC(=CCC\C(=C\CC[C@@](I)(C)[H])C)C
SPLASH splash10-07i2-6920000000-04f607b81865a07914db
Sample Comments E/Z = 92:8
Source of Spectrum QE-76-SM15-(S)-7g
Wiley ID 1843549