Results for:
PubChem ID: 11039

Methyl 2-methylpropanoate

Mass-Spectra

Compound Details

Synonymous names	methylisobutyrate Methyl methylpropanoate Methylester kyseliny isomaselne Methyl isobutanoate METHYL ISOBUTYRATE BHIWKHZACMWKOJ-UHFFFAOYSA-N Methyl methacrylate polymer Isobutyric acid methyl Methyl 2-methylpropanoate Methyl 2-methylpropionate Methacrylic Acid Methyl Ester Polymer ISOBUTYRIC ACID METHYL ESTER AC1L1WHK Methylester kyseliny isomaselne [Czech] 2-methylpropanoic acid methyl ester Isobutyric acid, methyl ester Methyl isobutyrate (natural) iso butyric acid methyl ester AC1Q41O5 Poly(D-lactide) KSC489Q2P Methyl isobutyrate, 99% ACMC-209ljh SCHEMBL66536 M0088 CTK3I9827 I0106 RP18768 ZINC388287 EM286QL922 CS-D1465 OR369397 SBB061111 NSC126780 DTXSID5060275 OR025023 OR035741 WLN: 1Y1&VO1 ZB011405 OR282955 UNII-EM286QL922 CHEBI:73689 Methyl isobutyrate, natural, 98% A830359 LS-84405 KB-54986 CJ-03189 SC-18496 BP-30192 ANW-32187 AN-45818 Methyl isobutyrate, 99%, FG MFCD00008914 ZINC00388287 Propanoic acid,2-methyl-, methyl ester RTR-019363 NSC 126780 NSC-126780 ST51047174 TR-019363 I14-2602 J-522610 AKOS005259719 FT-0628333 FEMA No. 2694 TRA-0191289 BRN 1740720 (CH3)2CHC(O)OCH3 Propanoic acid, 2-methyl-, methyl ester 547-63-7 MCULE-8740211817 EINECS 208-929-5 26161-42-2 Poly(L-lactide) 4.0 dl/g Poly(L-lactide) 2.0 dl/g Poly(L-lactide) 1.0 dl/g 106989-11-1 MolPort-002-461-935 MolPort-039-193-748 2-PROPENOIC ACID 2-METHYL- METHYL ESTER HOMOPOLYMER Poly(methyl methacrylate), MW ~ 550,000 50g InChI=1/C5H10O2/c1-4(2)5(6)7-3/h4H,1-3H
Microorganism:	Yes
IUPAC name	methyl 2-methylpropanoate
SMILES	CC(C)C(=O)OC
Inchi	InChI=1S/C5H10O2/c1-4(2)5(6)7-3/h4H,1-3H3
Formula	C5H10O2
PubChem ID	11039
Molweight	102.133
LogP	1.17
Atoms	17
Bonds	16
H-bond Acceptor	1
H-bond Donor	0
Chemical Classification	Esters

mVOC Specific Details

MS-Links	MS-MS Spectrum 124006 MS-MS Spectrum 66440 MS-MS Spectrum 124007 MS-MS Spectrum 66439 MS-MS Spectrum 66438 MS-MS Spectrum 124005
1D-NMR-Links	1D NMR Spectrum 4178 1D NMR Spectrum 3904

Microorganisms emitting the compound

Kingdom Species Biological Function Origin/Habitat Reference Bacteria Streptomyces Albus Subsp. Pathocidicus IFO 13812 n/a Schoeller et al., 2002 Bacteria Streptomyces Antibioticus ETH 22014 n/a Schoeller et al., 2002 Bacteria Streptomyces Aureofaciens ETH 13387 n/a Schoeller et al., 2002 Bacteria Streptomyces Aureofaciens ETH 28832 n/a Schoeller et al., 2002 Bacteria Streptomyces Coelicolor ATCC 21666 n/a Schoeller et al., 2002 Bacteria Streptomyces Hygroscopicus IFO 13255 n/a Schoeller et al., 2002 Bacteria Streptomyces Murinus NRRL 8171 n/a Schoeller et al., 2002 Bacteria Streptomyces Olivaceus ETH 7437 n/a Schoeller et al., 2002 Bacteria Streptomyces Thermoviolaceus CBS 111.62 n/a Schoeller et al., 2002 Bacteria Streptomyces Thermoviolaceus IFO 12382 n/a Schoeller et al., 2002 Bacteria Actinomycetes Spp. n/a Schulz and Dickschat, 2007 Bacteria Dyella Sp. AD56 na na Tyc et al., 2015 Fungi Muscodor Albus CZ-620 n/a Corcuff et al., 2011 Fungi Muscodor Crispans n/a Mitchell et al., 2010 Fungi Tuber Simonea March et al., 2006 Fungi Tuber Simonea n/a Ayme Truffe of Grignan, 26230 France March et al., 2006

Method

Kingdom Species Growth Medium Applied Method Verification Bacteria Streptomyces Albus Subsp. Pathocidicus IFO 13812 Emmerson's yeast starch agar Headspace trapping, GC-FID/GC-MS Bacteria Streptomyces Antibioticus ETH 22014 Emmerson's yeast starch agar Headspace trapping, GC-FID/GC-MS Bacteria Streptomyces Aureofaciens ETH 13387 Emmerson's yeast starch agar Headspace trapping, GC-FID/GC-MS Bacteria Streptomyces Aureofaciens ETH 28832 Emmerson's yeast starch agar Headspace trapping, GC-FID/GC-MS Bacteria Streptomyces Coelicolor ATCC 21666 Emmerson's yeast starch agar Headspace trapping, GC-FID/GC-MS Bacteria Streptomyces Hygroscopicus IFO 13255 Emmerson's yeast starch agar Headspace trapping, GC-FID/GC-MS Bacteria Streptomyces Murinus NRRL 8171 Emmerson's yeast starch agar Headspace trapping, GC-FID/GC-MS Bacteria Streptomyces Olivaceus ETH 7437 n/a n/a Bacteria Streptomyces Thermoviolaceus CBS 111.62 Emmerson's yeast starch agar Headspace trapping, GC-FID/GC-MS Bacteria Streptomyces Thermoviolaceus IFO 12382 Emmerson's yeast starch agar Headspace trapping, GC-FID/GC-MS Bacteria Actinomycetes Spp. n/a n/a Bacteria Dyella Sp. AD56 Tryptic soy broth agar GC/MS-Q-TOF No Fungi Muscodor Albus CZ-620 n/a Headspace sampler/GC-MS Fungi Muscodor Crispans potato dextrose agar SPME-GC-MS Fungi Tuber Simonea Pressure balanced head-space sampling and GC/TOF-MS No Fungi Tuber Simonea n/a Pressure balanced head-space sampling and GC/TOF-MS