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(3Z)-Hexenyl 2-methyl-2-pentenoate
SpectraBase Compound ID HkUAlFPQOMx
InChI InChI=1S/C12H20O2/c1-4-6-7-8-10-14-12(13)11(3)9-5-2/h6-7,9H,4-5,8,10H2,1-3H3/b7-6-,11-9+
InChIKey RTISFZCHFHFOOK-SXWITGCCSA-N
Mol Weight 196.29 g/mol
Molecular Formula C12H20O2
Exact Mass 196.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7bFGRurO3e5
Name (3Z)-Hexenyl 2-methyl-2-pentenoate
CAS Registry Number 76649-17-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O2
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness)
GC Oven Program 60 ??C to 246 ??C at 3 ??C/min.
InChI InChI=1S/C12H20O2/c1-4-6-7-8-10-14-12(13)11(3)9-5-2/h6-7,9H,4-5,8,10H2,1-3H3/b7-6-,11-9+
InChIKey RTISFZCHFHFOOK-SXWITGCCSA-N
Molecular Weight 196.290 g/mol
SMILES C(\C=C/CC)COC(\C(=C\CC)C)=O
SPLASH splash10-0159-9000000000-1c124c58e87e825c300e
Source ex BEDOUKIAN ex JJ BROPHY
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Synonyms Hexenyl 2-methyl-2-pentenoate<3Z->
Wiley ID 1886421