precursor
Showing entry for Cymene-p
Identification
- PhytoHub ID
- PHUB000039
- Name
- Cymene-p
- Synonyms
- Cymene
- Dolcymen
- Isopropyltoluene
- CAS Number
- Not Available
- Average Mass
- 134.222
- Monoisotopic Mass
- 134.109550451
- Chemical Formula
- C10H14
- IUPAC Name
- cymene
- InChI Key
- HFPZCAJZSCWRBC-UHFFFAOYSA-N
- InChI Identifier
InChI=1S/C10H14/c1-8(2)10-6-4-9(3)5-7-10/h4-8H,1-3H3
- SMILES
CC(C)C1=CC=C(C)C=C1
- Structure
Calculated Properties
External Links
- ChEBI
- 28768
- PubChem
- 7463
- Chemistry Dashboard
- DTXSID3026645
- KNApSAcK
- C00003040
- MetaboLights
- MTBLC28768
- FooDB (Compounds)
- FDB017358
Taxonomy
- Family
- Terpenoids
- Class
- Monoterpenoids
- Sub-class
- Not Available
Spectra
Record ID | Source | Description | View |
---|---|---|---|
JP001543 | MassBank | EI-B Spectrum - -, [M]+* | View Spectra |
JP007208 | MassBank | EI-B Spectrum - -, [M]+* | View Spectra |
JP007565 | MassBank | EI-B Spectrum - -, [M]+* | View Spectra |
Food Sources
Name | Group | |||
---|---|---|---|---|
Common thyme | Herbs and Spices | Publications | Show | |
Grape wine | Beverages, Alcoholic | Publications | Show |
Metabolism
Precursor | Metabolite | Species | Biofluids | Formula | Monoisotopic mass | |||
---|---|---|---|---|---|---|---|---|
Cymene-p | Cymen-9-ol (p-) | rabbit | urine | C10H14O | 150.104465071 | Publications | ||
Cymene-p | Tolylpropionic acid (alpha-,p-) | rabbit | urine | C10H12O2 | 164.083729626 | Publications | ||
Cymene-p | Cymen-8-ol (p-) | rabbit | urine | C10H14O | 150.104465071 | Publications | ||
Cymene-p | Tolyl-alpha-hydroxylpropionic acid (alpha-) | rabbit | urine | C10H12O3 | 180.078644246 | Publications | ||
Cymene-p | Tolylacrylic acid (alpha-) | rabbit | urine | C10H10O2 | 162.068079562 | Publications | ||
Cymene-p | Isopropylbenzoic acid (p-) | rabbit | urine | C10H12O2 | 164.083729626 | Publications | ||
Cymene-p | 1-Hydroxyisopropylbenzoic acid (p-) | rabbit | urine | C10H12O3 | 180.078644246 | Publications |