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4-Bromanyl-2-[(1R,2S)-1,2-dimethyl-3-methylidene-cyclopentyl]-3-iodanyl-5-methyl-phenol
SpectraBase Compound ID 7XXsvwAzfJx
InChI InChI=1S/C15H18BrIO/c1-8-5-6-15(4,10(8)3)12-11(18)7-9(2)13(16)14(12)17/h7,10,18H,1,5-6H2,2-4H3/t10-,15+/m0/s1
InChIKey JXIXIAABBVUSSF-ZUZCIYMTSA-N
Mol Weight 421.12 g/mol
Molecular Formula C15H18BrIO
Exact Mass 419.958573 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EaPL5B1VBvD
Name 4-Bromanyl-2-[(1R,2S)-1,2-dimethyl-3-methylidene-cyclopentyl]-3-iodanyl-5-methyl-phenol
CAS Registry Number 72008-57-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18BrIO
InChI InChI=1S/C15H18BrIO/c1-8-5-6-15(4,10(8)3)12-11(18)7-9(2)13(16)14(12)17/h7,10,18H,1,5-6H2,2-4H3/t10-,15+/m0/s1
InChIKey JXIXIAABBVUSSF-ZUZCIYMTSA-N
Molecular Weight 421.116 g/mol
SMILES Oc1c([C@]2([C@](C(=C)CC2)(C)[H])C)c(c(Br)c(c1)C)I
SPLASH splash10-0a4l-9000000000-c7e1edd766f25310d488
Source of Spectrum C-101-6137-0
Synonyms 4-Bromo-2-[(1R,2S)-1,2-dimethyl-3-methylene-cyclopentyl]-3-iodo-5-methyl-phenol 4-Bromo-2-[(1R,2S)-1,2-dimethyl-3-methylidenecyclopentyl]-3-iodo-5-methylphenol
Wiley ID 1377743