Results for:
PubChem ID: 8186

Undecanal

Mass-Spectra

Compound Details

Synonymous names	Hendecanaldehyde Undecanaldehyde Undecylaldehyde Hendecanal UNDECANAL KMPQYAYAQWNLME-UHFFFAOYSA-N Undecylic aldehyde Undecyl aldehyde n-Undecanal Undecanal, analytical standard n-Undecyl aldehyde AC1L1QGJ 1-Undecanal aldehyde C11 undecylic 1gt4 B6P0A9PSHN Undecanal (natural) AC1Q2VZ8 C11 aldehyde ACMC-1C9IB Undecanone, alpha- UNII-B6P0A9PSHN KSC176I9N 1e02 Undecanal, 97% SCHEMBL22333 CTK0H6496 Aldehyde C-11 U0009 DB04093 NSC22578 WLN: VH10 AK122349 LS-3142 LP001419 SBB059873 DTXSID4021688 C-11 aldehyde, undecylic Aldehyde C-11, undecylic CHEMBL1236576 ZINC1595727 DSSTox_CID_1688 CHEBI:46202 API0004551 NSC-22578 NSC 22578 ANW-16473 CC-35541 AN-22702 Undecanal, FCC, >=96% TRA0160394 KB-62198 DSSTox_GSID_21688 DSSTox_RID_76284 C-30889 MFCD00007016 LMFA06000064 RTR-002436 ST24031982 ST51046138 CS-W004300 TR-002436 AI3-05098 J-002779 AKOS009158017 FT-0631645 FEMA No. 3092 BRN 1753213 I14-13646 Tox21_200538 112-44-7 NCGC00258092-01 NCGC00248685-01 MCULE-2842613213 EINECS 203-972-6 CAS-112-44-7
Microorganism:	Yes
IUPAC name	undecanal
SMILES	CCCCCCCCCCC=O
Inchi	InChI=1S/C11H22O/c1-2-3-4-5-6-7-8-9-10-11-12/h11H,2-10H2,1H3
Formula	C11H22O
PubChem ID	8186
Molweight	170.296
LogP	3.88
Atoms	34
Bonds	33
H-bond Acceptor	1
H-bond Donor	0
Chemical Classification	Aldehydes

mVOC Specific Details

MS-Links	MS-MS Spectrum 6947 MS-MS Spectrum 6949 MS-MS Spectrum 13620 MS-MS Spectrum 6948 MS-MS Spectrum 13621 MS-MS Spectrum 13619
1D-NMR-Links	1D NMR Spectrum 3800 1D NMR Spectrum 4065

Microorganisms emitting the compound

Kingdom Species Biological Function Origin/Habitat Reference Bacteria Streptococcus Mutans DSM 20523 as a biomarker for a breath test for detection of caries Hertel et al., 2015 Bacteria Burkholderia Cepacia LMG 1222 n/a Blom et al., 2011 Bacteria Burkholderia Cepacia LMG 1222 358 Rhizosphere Blom et al., 2011 Bacteria Burkholderia Gladioli LMG 2216 n/a Blom et al., 2011 Bacteria Burkholderia Lata LMG 22485 n/a Blom et al., 2011 Bacteria Burkholderia Lata LMG 6993 n/a Blom et al., 2011 Bacteria Burkholderia Phenoliruptrix LMG 22037 n/a Blom et al., 2011 Bacteria Burkholderia Pyrrocinia LMG 21822 n/a Blom et al., 2011 Bacteria Dinoroseobacter Shibae Strain DFL-27 n/a Dickschat et al., 2005_4 Bacteria Loktanella Sp. Bio-204 n/a Dickschat et al., 2005_4 Bacteria Serratia Plymuthica IC14 n/a Blom et al., 2011 Bacteria Serratia Proteamaculans B5a n/a Blom et al., 2011 Fungi Ganoderma Lucidum na saprophytic on deciduous trees Ziegenbein et al., 2006

Method

Kingdom Species Growth Medium Applied Method Verification Bacteria Streptococcus Mutans DSM 20523 Brain-Heart-Infusion agar Tenaxâ„¢-trap/GC-MS Bacteria Burkholderia Cepacia LMG 1222 MR-VP Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD) Bacteria Burkholderia Cepacia LMG 1222 358 MR-VP Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD) Yes Bacteria Burkholderia Gladioli LMG 2216 LB and MR-VP Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD) Bacteria Burkholderia Lata LMG 22485 MR-VP and Angle Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD) Bacteria Burkholderia Lata LMG 6993 MR-VP Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD) Bacteria Burkholderia Phenoliruptrix LMG 22037 Angle Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD) Bacteria Burkholderia Pyrrocinia LMG 21822 LB and Angle Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD) Bacteria Dinoroseobacter Shibae Strain DFL-27 n/a n/a Bacteria Loktanella Sp. Bio-204 n/a n/a Bacteria Serratia Plymuthica IC14 MR-VP and Angle Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD) Bacteria Serratia Proteamaculans B5a MR-VP Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD) Fungi Ganoderma Lucidum na GC/MS No