2-[(2S,4aR,8aS)-2-Hydroxy-4a-methyl-8-methylenedecahydro-2-naphthalenyl]acrylic acid
8135
Reference
2-[(2S,4aR,8aS)-2-Hydroxy-4a-methyl-8-methylenedecahydro-2-naphthalenyl]acrylic acid Structure
Systematic / IUPAC Name: 2-[(2S,4aR,8aS)-2-Hydroxy-4a-methyl-8-methylidene-3,4,5,6,7,8a-hexahydro-1H-naphthalen-2-yl]prop-2-enoic acid
ID: Reference8135
Other Names: 2-Naphthaleneacetic acid, decahydro-2-hydroxy-4a-methyl-α,8-bis(methylene)-, (2S,4aR,8aS)-
Formula: C15H22O3
Spectral Data
2-[(2S,4aR,8aS)-2-Hydroxy-4a-methyl-8-methylenedecahydro-2-naphthalenyl]acrylic acid mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Orbitrap Fusion Lumos with ETD LBP FAIMS |
| No. of Spectral Trees | 1 |
| No. of Spectra | 255 |
| Tandem Spectra | MS1, MS2, MS3 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 8/7/2018 8:39:59 AM |
Identificators
| InChI | InChI=1S/C15H22O3/c1-10-5-4-6-14(3)7-8-15(18,9-12(10)14)11(2)13(16)17/h12,18H,1-2,4-9H2,3H3,(H,16,17)/t12-,14+,15-/m0/s1 |
| InChI Key | WQMBCGHXXVLQTE-CFVMTHIKSA-N |
| Canonical SMILES | CC12CCCC(=C)C1CC(CC2)(C(=C)C(=O)O)O |
| CAS | |
| Splash | |
| Other Names | 2-Naphthaleneacetic acid, decahydro-2-hydroxy-4a-methyl-α,8-bis(methylene)-, (2S,4aR,8aS)- |