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4-(1-Phenylethyl)-4-heptanol
SpectraBase Compound ID GhYqfKYvEdc
InChI InChI=1S/C15H24O/c1-4-11-15(16,12-5-2)13(3)14-9-7-6-8-10-14/h6-10,13,16H,4-5,11-12H2,1-3H3
InChIKey YJNLTYCEAXQFIW-UHFFFAOYSA-N
Mol Weight 220.36 g/mol
Molecular Formula C15H24O
Exact Mass 220.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EhawHRkiNGZ
Name 4-(1-phenylethyl)heptan-4-ol
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 220.182715392 u
Formula C15H24O
InChI InChI=1S/C15H24O/c1-4-11-15(16,12-5-2)13(3)14-9-7-6-8-10-14/h6-10,13,16H,4-5,11-12H2,1-3H3
InChIKey YJNLTYCEAXQFIW-UHFFFAOYSA-N
Instrument Name Finnigan MAT95Q or Finnigan MAT90
Ionization Type EI
Literature Reference DOI 10.1002/anie.202203807
Molecular Weight 220.356 g/mol
Quality 177
Reported Formula C15H24O
SMILES OC(C(C1=CC=CC=C1)C)(CCC)CCC
SPLASH splash10-066r-5900000000-369fcdcb1c0797cdd9da
Source of Spectrum ACI-61-SM57-10ab (DOI: 10.1002/anie.202203807)
Wiley ID 1897771