Flavors & Fragrances

Cas#: 27538-09-6        Compound CID:  93111

Formula:  C₇H₁₀O₃        Molecular Weight: 142.15

IUPAC Name: 5-ethyl-4-hydroxy-2-methylfuran-3-one

SMILES: CCC1=C(C(=O)C(O1)C)O

InChIKey: QJYOEDXNPLUUAR-UHFFFAOYSA-N

InChI: InChI=1S/C7H10O3/c1-3-5-7(9)6(8)4(2)10-5/h4,9H,3H2,1-2H3

Cas#: 35158-25-9        Compound CID:  5362661

Formula:  C₁₀H₁₈O        Molecular Weight: 154.25

IUPAC Name: (E)-5-methyl-2-propan-2-ylhex-2-enal

SMILES: CC(C)CC=C(C=O)C(C)C

InChIKey: IOLQAHFPDADCHJ-POHAHGRESA-N

InChI: InChI=1S/C10H18O/c1-8(2)5-6-10(7-11)9(3)4/h6-9H,5H2,1-4H3/b10-6-

Cas#: 106-23-0        Compound CID:  7794

Formula:  C₁₀H₁₈O        Molecular Weight: 154.25

IUPAC Name: 3,7-dimethyloct-6-enal

SMILES: CC(CCC=C(C)C)CC=O

InChIKey: NEHNMFOYXAPHSD-UHFFFAOYSA-N

InChI: InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,8,10H,4,6-7H2,1-3H3

Cas#: 7585-39-9        Compound CID:  444041

Formula:  C₄₂H₇₀O₃₅        Molecular Weight: 1134.98

IUPAC Name: (1S,3R,5R,6S,8R,10R,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,31S,33R,35R,36R,37R,38R,39R,40R,41R,42R,43R,44R,45R,46R,47R,48R,49R)-5,10,15,20,25,30,35-heptakis(hydroxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29,32,34-tetradecaoxaoctacyclo[31.2.2.23,6.28,11.213,16.218,21.223,26.228,31]nonatetracontane-36,37,38,39,40,41,42,43,44,45,46,47,48,49-tetradecol

SMILES: OC[C@H]1O[C@@H]2O[C@H]3[C@H](O)[C@@H](O)[C@H](O[C@@H]3CO)O[C@H]4[C@H](O)[C@@H](O)[C@H](O[C@@H]4CO)O[C@H]5[C@H](O)[C@@H](O)[C@H](O[C@@H]5CO)O[C@H]6[C@H](O)[C@@H](O)[C@H](O[C@@H]6CO)O[C@H]7[C@H](O)[C@@H](O)[C@H](O[C@@H]7CO)O[C@H]8[C@H](O)[C@@H](O)[C@H](O[C@@H]8CO)O[C@H]1[C@H](O)[C@H]2O

InChIKey: WHGYBXFWUBPSRW-FOUAGVGXSA-N

InChI: InChI=1S/C42H70O35/c43-1-8-29-15(50)22(57)36(64-8)72-30-9(2-44)66-38(24(59)17(30)52)74-32-11(4-46)68-40(26(61)19(32)54)76-34-13(6-48)70-42(28(63)21(34)56)77-35-14(7-49)69-41(27(62)20(35)55)75-33-12(5-47)67-39(25(60)18(33)53)73-31-10(3-45)65-37(71-29)23(58)16(31)51/h8-63H,1-7H2/t8-,9-,10-,11-,12-,13-,14-,15-,16-,17-,18-,19-,20-,21-,22-,23-,24-,25-,26-,27-,28-,29-,30-,31-,32-,33-,34-,35-,36-,37-,38-,39-,40-,41-,42-/m1/s1

Cas#: 624-09-9        Compound CID:  69350

Formula:  C₁₄H₂₈O₂        Molecular Weight: 228.38

IUPAC Name: heptyl heptanoate

SMILES: CCCCCCCOC(=O)CCCCCC

InChIKey: QOIIBPAJVWFEPE-UHFFFAOYSA-N

InChI: InChI=1S/C14H28O2/c1-3-5-7-9-11-13-16-14(15)12-10-8-6-4-2/h3-13H2,1-2H3

Cas#: 114099-96-6        Compound CID:  19872333

Formula:  C₁₀H₁₄O₄        Molecular Weight: 198.22

IUPAC Name: (2,5-dimethyl-4-oxofuran-3-yl) butanoate

SMILES: CCCC(=O)OC1=C(OC(C1=O)C)C

InChIKey: JOLGAERKCZYHLF-UHFFFAOYSA-N

InChI: InChI=1S/C10H14O4/c1-4-5-8(11)14-10-7(3)13-6(2)9(10)12/h6H,4-5H2,1-3H3

Cas#: 91-10-1        Compound CID:  7041

Formula:  C₈H₁₀O₃        Molecular Weight: 154.16

IUPAC Name: 2,6-dimethoxyphenol

SMILES: COC1=C(C(=CC=C1)OC)O

InChIKey: KLIDCXVFHGNTTM-UHFFFAOYSA-N

InChI: InChI=1S/C8H10O3/c1-10-6-4-3-5-7(11-2)8(6)9/h3-5,9H,1-2H3