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Cyclohexyl butyrate
SpectraBase Compound ID IwtZ2VLx4nf
InChI InChI=1S/C10H18O2/c1-2-6-10(11)12-9-7-4-3-5-8-9/h9H,2-8H2,1H3
InChIKey VZHUBBUZNIULNM-UHFFFAOYSA-N
Mol Weight 170.25 g/mol
Molecular Formula C10H18O2
Exact Mass 170.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9aCB7U1foaQ
Name Cyclohexyl butyrate
CAS Registry Number 1551-44-6
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 170.130679818 u
Formula C10H18O2
InChI InChI=1S/C10H18O2/c1-2-6-10(11)12-9-7-4-3-5-8-9/h9H,2-8H2,1H3
InChIKey VZHUBBUZNIULNM-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 170.252 g/mol
Nominal Mass 170 u
Quality 1000
Retention Index 1232
SMILES C1(OC(CCC)=O)CCCCC1
SPLASH splash10-00su-9000000000-9bae488d6df348e8da33
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Cyclohexyl butanoate
Technique GC/MS
Wiley ID DD2024_022264