1.02010-04-08 22:10:43 UTC2019-11-26 03:08:27 UTCFDB0134583,4-Dihydro-5-propanoyl-2H-pyrroleFormed by thermal treatment of proline and glucose mixtures. Constituent of freshly popped corn aroma1-(3,4-Dihydro-2H-pyrrol-5-yl)-1-propanone, 9CI1-Pyrroline, 2-propanoyl2-Propionyl-1-pyrrolineC7H11NO125.1683125.0840639791-(3,4-dihydro-2H-pyrrol-5-yl)propan-1-one1-(4,5-dihydro-3H-pyrrol-2-yl)propan-1-one133447-37-7CCC(=O)C1=NCCC1InChI=1S/C7H11NO/c1-2-7(9)6-4-3-5-8-6/h2-5H2,1H3OVNCGQSYSSYBPO-UHFFFAOYSA-N belongs to the class of organic compounds known as pyrrolines. Pyrrolines are compounds containing a pyrroline ring, which is a five-member unsaturated aliphatic ring with one nitrogen atom and four carbon atoms.PyrrolinesOrganic compoundsOrganoheterocyclic compoundsPyrrolinesAliphatic heteromonocyclic compoundsAzacyclic compoundsHydrocarbon derivativesKetiminesKetonesOrganic oxidesOrganopnictogen compoundsPropargyl-type 1,3-dipolar organic compoundsAliphatic heteromonocyclic compoundAzacycleCarbonyl groupHydrocarbon derivativeImineKetimineKetoneOrganic 1,3-dipolar compoundOrganic nitrogen compoundOrganic oxideOrganic oxygen compoundOrganonitrogen compoundOrganooxygen compoundOrganopnictogen compoundPropargyl-type 1,3-dipolar organic compoundPyrrolinelogp0.78logs-1.71solubility2.43e+00 g/llogp1.56pka_strongest_acidic19.02pka_strongest_basic3.84iupac1-(3,4-dihydro-2H-pyrrol-5-yl)propan-1-oneaverage_mass125.1683mono_mass125.084063979smilesCCC(=O)C1=NCCC1formulaC7H11NOinchiInChI=1S/C7H11NO/c1-2-7(9)6-4-3-5-8-6/h2-5H2,1H3inchikeyOVNCGQSYSSYBPO-UHFFFAOYSA-Npolar_surface_area29.43refractivity36.02polarizability14.1rotatable_bond_count2acceptor_count2donor_count0physiological_charge0formal_charge0Specdb::CMs11290Specdb::CMs162407Specdb::MsIr6716Specdb::MsIr6717Specdb::MsMs61947Specdb::MsMs61948Specdb::MsMs61949Specdb::MsMs118581Specdb::MsMs118582Specdb::MsMs118583Specdb::MsMs2377654Specdb::MsMs2377655Specdb::MsMs2377656Specdb::MsMs2561931Specdb::MsMs2561932Specdb::MsMs2561933Specdb::NmrOneD128128Specdb::NmrOneD128129Specdb::NmrOneD128130Specdb::NmrOneD128131Specdb::NmrOneD128132Specdb::NmrOneD128133Specdb::NmrOneD128134Specdb::NmrOneD128135Specdb::NmrOneD128136Specdb::NmrOneD128137Specdb::NmrOneD128138Specdb::NmrOneD128139Specdb::NmrOneD128140Specdb::NmrOneD128141Specdb::NmrOneD128142Specdb::NmrOneD128143Specdb::NmrOneD128144Specdb::NmrOneD128145Specdb::NmrOneD128146Specdb::NmrOneD128147HMDB34883#<Reference:0x000055567423b7a0>Tortilla chipType 2specificfishyroastroasted