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Cyclopentanone, 3-(6,6-dimethyl-5-oxo-2-heptenyl)-, (E)-
SpectraBase Compound ID Htvai9roS77
InChI InChI=1S/C14H22O2/c1-14(2,3)13(16)7-5-4-6-11-8-9-12(15)10-11/h4-5,11H,6-10H2,1-3H3/b5-4+
InChIKey XOFLWVZMVUWVEA-SNAWJCMRSA-N
Mol Weight 222.33 g/mol
Molecular Formula C14H22O2
Exact Mass 222.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HJsaIbFeTpq
Name Cyclopentanone, 3-(6,6-dimethyl-5-oxo-2-heptenyl)-, (E)-
CAS Registry Number 83040-98-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O2
InChI InChI=1S/C14H22O2/c1-14(2,3)13(16)7-5-4-6-11-8-9-12(15)10-11/h4-5,11H,6-10H2,1-3H3/b5-4+
InChIKey XOFLWVZMVUWVEA-SNAWJCMRSA-N
Molecular Weight 222.328 g/mol
SMILES C1(=O)CCC(C1)C\C=C\CC(=O)C(C)(C)C
SPLASH splash10-0a4i-9100000000-ed6bb9e7d8bb563d2a2c
Source of Spectrum H-65-436-0
Synonyms 3-[(2E)-6,6-Dimethyl-5-oxo-2-heptenyl]cyclopentanone 3-[(E)-5-keto-6,6-dimethyl-hept-2-enyl]cyclopentanone 3-[(E)-6,6-dimethyl-5-oxidanylidene-hept-2-enyl]cyclopentan-1-one 3-[(E)-6,6-dimethyl-5-oxo-hept-2-enyl]cyclopentanone 3-[(E)-6,6-dimethyl-5-oxohept-2-enyl]-1-cyclopentanone 3-[(E)-6,6-dimethyl-5-oxohept-2-enyl]cyclopentan-1-one
Wiley ID 1222793