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4-iodo-2-pentylbenzaldehyde
SpectraBase Compound ID Fnz5iB0W5pP
InChI InChI=1S/C12H15IO/c1-2-3-4-5-10-8-12(13)7-6-11(10)9-14/h6-9H,2-5H2,1H3
InChIKey GQHRJJFYCQDLCF-UHFFFAOYSA-N
Mol Weight 302.16 g/mol
Molecular Formula C12H15IO
Exact Mass 302.01676 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Y4wReGjkYI
Name 4-iodo-2-pentylbenzaldehyde
Appearance Brownish oil
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 302.016760102 u
Formula C12H15IO
InChI InChI=1S/C12H15IO/c1-2-3-4-5-10-8-12(13)7-6-11(10)9-14/h6-9H,2-5H2,1H3
InChIKey GQHRJJFYCQDLCF-UHFFFAOYSA-N
Instrument Name Finnigan MAT95Q or Finnigan MAT90
Ionization Type EI positive ion
Literature Reference DOI 10.1002/chem.201604237
Molecular Weight 302.155 g/mol
Quality 226
SMILES C1(I)=CC(=C(C=C1)C=O)CCCCC
SPLASH splash10-0kdl-4954000000-0fedf004e6fdfa68b1b4
Source of Spectrum QE-22-SM7-3 (DOI: 10.1002/chem.201604237)
Wiley ID 1905292