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Citronellyl acetate
SpectraBase Compound ID DBfoM8v1QyY
InChI InChI=1S/C12H22O2/c1-10(2)6-5-7-11(3)8-9-14-12(4)13/h6,11H,5,7-9H2,1-4H3
InChIKey JOZKFWLRHCDGJA-UHFFFAOYSA-N
Mol Weight 198.31 g/mol
Molecular Formula C12H22O2
Exact Mass 198.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ojTl8QXfUA
Name Citronellyl acetate
Carrier Gas Helium (1.0 mL/min)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 198.161979946 u
Formula C12H22O2
GC Column DB-5MS (30 m x 0.25 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 250oC
InChI InChI=1S/C12H22O2/c1-10(2)6-5-7-11(3)8-9-14-12(4)13/h6,11H,5,7-9H2,1-4H3
InChIKey JOZKFWLRHCDGJA-UHFFFAOYSA-N
Inlet Type split (20:1)
Instrument Name Shimadzu GC/MS-QP 2010SE
Ionization Type EI
Literature Reference DOI 10.1002/cbdv.202300793
Molecular Weight 198.306 g/mol
Quality 412
SMILES CC(=O)OCCC(CCC=C(C)C)C
SPLASH splash10-00l6-9100000000-3daddd1ab26baf33b174
Source of Spectrum CBD-20-SM2-No-9 (DOI: 10.1002/cbdv.202300793)
Wiley ID 1909983