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1-(3-chlorocyclopentyl)penta-3,4-dien-2-one
SpectraBase Compound ID 2046Il5idEy
InChI InChI=1S/C10H13ClO/c1-2-3-10(12)7-8-4-5-9(11)6-8/h3,8-9H,1,4-7H2
InChIKey OKBNXLWXEQWLBQ-UHFFFAOYSA-N
Mol Weight 184.67 g/mol
Molecular Formula C10H13ClO
Exact Mass 184.065493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 10AhO5UMOC8
Name 1-(3-chlorocyclopentyl)penta-3,4-dien-2-one
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H13ClO
InChI InChI=1S/C10H13ClO/c1-2-3-10(12)7-8-4-5-9(11)6-8/h3,8-9H,1,4-7H2
InChIKey OKBNXLWXEQWLBQ-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1021/acs.orglett.1c00452
Molecular Weight 184.666 g/mol
SMILES C1(Cl)CC(CC(=O)C=C=C)CC1
SPLASH splash10-001i-9300000000-0954635be99f413568cd
Sample Comments dr = 1.4:1
Source of Spectrum A1-23-SM27-3ma
Wiley ID 1865995