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2-Hepten-1-ol, (E)-
SpectraBase Compound ID BVzibpeQ4hl
InChI InChI=1S/C7H14O/c1-2-3-4-5-6-7-8/h5-6,8H,2-4,7H2,1H3/b6-5+
InChIKey ASFYPVGAALGVNR-AATRIKPKSA-N
Mol Weight 114.19 g/mol
Molecular Formula C7H14O
Exact Mass 114.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 10EruUGTq9T
Name Hepten-1-ol<2E->
CAS Registry Number 33467-76-4
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 114.104465070 u
Formula C7H14O
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness)
GC Oven Program 60 °C to 246 °C at 3 °C/min.
InChI InChI=1S/C7H14O/c1-2-3-4-5-6-7-8/h5-6,8H,2-4,7H2,1H3/b6-5+
InChIKey ASFYPVGAALGVNR-AATRIKPKSA-N
Molecular Weight 114.188 g/mol
Nominal Mass 114 u
Number of Peaks 56
SMILES OC\C=C\CCCC
SPLASH splash10-0a4l-9000000000-b531e55f635fd757b073
Source ex BEDOUKIAN CHEM. ex JJ BROPHY
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID RA001683