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1,3,5-Cycloheptatriene, 1-butyl-6-iodo-
SpectraBase Compound ID CD4gX98t4Bx
InChI InChI=1S/C11H15I/c1-2-3-6-10-7-4-5-8-11(12)9-10/h4-5,7-8H,2-3,6,9H2,1H3
InChIKey CDUUDDHQYJGHHZ-UHFFFAOYSA-N
Mol Weight 274.15 g/mol
Molecular Formula C11H15I
Exact Mass 274.021845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 28amgf6cznY
Name 1,3,5-Cycloheptatriene, 1-butyl-6-iodo-
CAS Registry Number 73172-92-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H15I
InChI InChI=1S/C11H15I/c1-2-3-6-10-7-4-5-8-11(12)9-10/h4-5,7-8H,2-3,6,9H2,1H3
InChIKey CDUUDDHQYJGHHZ-UHFFFAOYSA-N
Molecular Weight 274.145 g/mol
SMILES C1(=CC=CC=C(C1)CCCC)I
SPLASH splash10-0a4i-1900000000-d99fb206dd1bc64d6dc4
Source of Spectrum J-50-184-25
Synonyms 1-Butyl-6-iodo-1,3,5-cycloheptatriene
Wiley ID 1277688