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3-Hexene, 1,1-diethoxy-, (Z)-
SpectraBase Compound ID CfahBKXN2sk
InChI InChI=1S/C10H20O2/c1-4-7-8-9-10(11-5-2)12-6-3/h7-8,10H,4-6,9H2,1-3H3/b8-7-
InChIKey IOBHVJHSBREPFR-FPLPWBNLSA-N
Mol Weight 172.27 g/mol
Molecular Formula C10H20O2
Exact Mass 172.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2pc8M4XSPA
Name Hexenal
CAS Registry Number 73545-18-3
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 172.146329882 u
Formula C10H20O2
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/C10H20O2/c1-4-7-8-9-10(11-5-2)12-6-3/h7-8,10H,4-6,9H2,1-3H3/b8-7-
InChIKey IOBHVJHSBREPFR-FPLPWBNLSA-N
Molecular Weight 172.268 g/mol
Nominal Mass 172 u
Number of Peaks 70
SMILES C(OCC)(OCC)C\C=C/CC
SPLASH splash10-0f92-9300000000-f75487f40aaa3f5c099e
Source ex BEDOUKIAN RES.
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID RA001715