Results for:
PubChem ID: 11262

3-methylpentan-2-one

Mass-Spectra

Compound Details

Synonymous names
3-Methyl-2-pentanone
565-61-7
3-METHYLPENTAN-2-ONE
2-Pentanone, 3-methyl-
Methyl sec-butyl ketone
sec-Butyl methyl ketone
Methyl 1-methylpropyl ketone
3-methyl-pentan-2-one
DTXSID4021634
(3R)-3-methylpentan-2-one
(3S)-3-methylpentan-2-one
EINECS 209-282-1
NSC 66492
methylethylacetone
MFCD00009336
sec-C4H9COCH3
EC 209-282-1
SCHEMBL93407
3-Methyl-2-pentanone, 99%
DTXCID801634
CHEMBL3182903
UIHCLUNTQKBZGK-UHFFFAOYSA-
CHEBI:195650
NSC66492
Tox21_200530
LMFA12000027
NSC-66492
AKOS009031605
NCGC00248679-01
NCGC00258084-01
AS-31209
CAS-565-61-7
DB-052938
M0388
NS00004347
EN300-19776
Q15720827
InChI=1/C6H12O/c1-4-5(2)6(3)7/h5H,4H2,1-3H3
2695-53-6
57968-72-6
Microorganism:

Yes

IUPAC name3-methylpentan-2-one
SMILESCCC(C)C(=O)C
InchiInChI=1S/C6H12O/c1-4-5(2)6(3)7/h5H,4H2,1-3H3
FormulaC6H12O
PubChem ID11262
Molweight100.16
LogP1.3
Atoms7
Bonds2
H-bond Acceptor1
H-bond Donor0
Chemical Classificationketones
CHEBI-ID195650
Supernatural-IDSN0371219

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaPseudomonas AeruginosaNANABean et al. 2016
ProkaryotaPseudomonas AeruginosaNANABean et al. 2012
ProkaryotaBacillus PumilusLobaria pulmonaria lichen thalli, AustriaCernava et al. 2015
ProkaryotaBacillus SubtilisZhang et al. 2021
ProkaryotaSerratia Liquefaciensstimulate growth in Arabidopsis thaliana seedlings depending on inoculum concentrationavocado trees (Persea americana) rhizosphereGamboa-Becerra et al. 2022
ProkaryotaPseudomonas Palleronianaavocado trees (Persea americana) rhizosphereGamboa-Becerra et al. 2022
ProkaryotaArthrobacter Nicotinovoransstimulate growth in Arabidopsis thaliana seedlings depending on inoculum concentrationavocado trees (Persea americana) rhizosphereGamboa-Becerra et al. 2022
ProkaryotaBacillus Atrophaeusgrowth stimulation effects on Solanum tuberosum tubers (potato) and Zea mays seeds (maize)NAMülner et al. 2020
ProkaryotaBacillus AmyloliquefaciensLeibnitz Institute DSMZ-German Collection of Microorganisms and Cell Cultures GmbHMülner et al. 2020
ProkaryotaBacillus AmyloliquefaciensNAMülner et al. 2020
ProkaryotaBacillus Velezensisgrowth stimulation effects on Solanum tuberosum tubers (potato) and Zea mays seeds (maize)Leibnitz Institute DSMZ-German Collection of Microorganisms and Cell Cultures GmbHMülner et al. 2020
ProkaryotaBacillus Velezensisgrowth stimulation effects on Solanum tuberosum tubers (potato) and Zea mays seeds (maize)NAMülner et al. 2020
ProkaryotaBacillus VelezensisNAMülner et al. 2020
ProkaryotaBacillus PumilusNAMülner et al. 2020
EukaryotaChaetomium IndicumNAMoisan et al. 2021
ProkaryotaSphingopyxis Litorisisolate from the algal Chromera velia CCAP 1602/1Koteska et al. 2023
EukaryotaMalassezia GlobosaFungal Biodiversity Center (WesterdijkInstitute, Utrecht, The Netherlands)Rios-Navarro et al. 2023
EukaryotaMalassezia RestrictaFungal Biodiversity Center (WesterdijkInstitute, Utrecht, The Netherlands)Rios-Navarro et al. 2023
ProkaryotaCollimonas Pratensisn/aNAGarbeva et al. 2014
EukaryotaAspergillus VersicolorNASunesson et al. 1995
ProkaryotaThermoactinomyces VulgarisnasoilWilkins 1996
ProkaryotaCollimonas Pratensisnarhizosphere of Marram grass in sandy dune soils, NetherlandsGarbeva et al. 2014
EukaryotaAspergillus Versicolornadamp indoor environments, food productsSunesson et al. 1995
ProkaryotaActinomycetes Sp.n/aNASchulz and Dickschat 2007
ProkaryotaPaenibacillus Polymyxacollection TU GrazRybakova et al. 2017
ProkaryotaBacillus AtrophaeusNANAToral et al. 2021
Lentinula EdodesGeng et al. 2024
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaPseudomonas AeruginosaLB-LennoxSPME/GC-MSno
ProkaryotaPseudomonas Aeruginosalysogeny brothSPME/GCxGC-MSno
ProkaryotaBacillus PumilusR2AGC/MS SPMEno
ProkaryotaBacillus SubtilisLB mediaHS-SPME/GC-MSno
ProkaryotaSerratia LiquefaciensLB mediaSPME/GC-MSno
ProkaryotaPseudomonas PalleronianaLB mediaSPME/GC-MSno
ProkaryotaArthrobacter NicotinovoransLB mediaSPME/GC-MSno
ProkaryotaBacillus Atrophaeusnutrient agarHS-SPME/GC-MSno
ProkaryotaBacillus Amyloliquefaciensnutrient agarHS-SPME/GC-MSno
ProkaryotaBacillus Velezensisnutrient agarHS-SPME/GC-MSno
ProkaryotaBacillus Pumilusnutrient agarHS-SPME/GC-MSno
EukaryotaChaetomium Indicum1/5th PDA mediumGC-MSno
ProkaryotaSphingopyxis Litorismarine broth agarOSSA/GC-MSno
EukaryotaMalassezia Globosamodified Dixon agarHS-SPME/GC-MSno
EukaryotaMalassezia Restrictamodified Dixon agarHS-SPME/GC-MSno
ProkaryotaCollimonas PratensisHeadspace trapping/GC-MSno
EukaryotaAspergillus Versicolorno
ProkaryotaThermoactinomyces VulgarisNutrient agar CM3GC/MSno
ProkaryotaCollimonas Pratensissand containing artificial root exudatesGC/MSno
EukaryotaAspergillus VersicolorDG18GC/MSno
ProkaryotaActinomycetes Sp.n/an/ano
ProkaryotaPaenibacillus PolymyxaGC-MS / SPMEno
ProkaryotaBacillus AtrophaeusSchaeffer’s growth (SG) mediumHS-SPME-GC/MSno
ProkaryotaBacillus Atrophaeustryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno
Lentinula EdodesJiuqu (traditional wheat Qu)GC-IMSno