![4-Methyl-5-(6-methylheptan-2-yl)-13-(3-oxopropyl)tricyclo[7.6.0.0(4,8)]pentadec-11-en-9-ol isomer](/api/spectrum/BuS2MlfeWS0/structure.png?h=300&w=458 "4-Methyl-5-(6-methylheptan-2-yl)-13-(3-oxopropyl)tricyclo[7.6.0.0(4,8)]pentadec-11-en-9-ol isomer")
| SpectraBase Compound ID | 2khilY73Lvp |
|---|---|
| InChI | InChI=1S/C27H46O2/c1-20(2)8-5-9-21(3)24-14-15-25-26(24,4)18-16-23-13-12-22(11-7-19-28)10-6-17-27(23,25)29/h6,10,19-25,29H,5,7-9,11-18H2,1-4H3/b10-6-/t21?,22-,23+,24+,25+,26+,27-/m0/s1 |
| InChIKey | AHBRHDBFIMBXCK-VJOXFUHTSA-N |
| Mol Weight | 402.7 g/mol |
| Molecular Formula | C27H46O2 |
| Exact Mass | 402.349781 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | BuS2MlfeWS0 |
|---|---|
| Name | 4-Methyl-5-(6-methylheptan-2-yl)-13-(3-oxopropyl)tricyclo[7.6.0.0(4,8)]pentadec-11-en-9-ol isomer |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H46O2 |
| InChI | InChI=1S/C27H46O2/c1-20(2)8-5-9-21(3)24-14-15-25-26(24,4)18-16-23-13-12-22(11-7-19-28)10-6-17-27(23,25)29/h6,10,19-25,29H,5,7-9,11-18H2,1-4H3/b10-6-/t21?,22-,23+,24+,25+,26+,27-/m0/s1 |
| InChIKey | AHBRHDBFIMBXCK-VJOXFUHTSA-N |
| Molecular Weight | 402.663 g/mol |
| SMILES | O[C@@]12[C@]3([C@@]([C@](CC3)(C(CCCC(C)C)C)[H])(CC[C@]2(CC[C@@](CCC=O)([H])\C=C/C1)[H])C)[H] |
| SPLASH | splash10-0imi-0092200000-1a0e6b6060896fe905cf |
| Source of Spectrum | F-70-8289-33 |
| Wiley ID | 1597555 |