| SpectraBase Spectrum ID |
39ayhjKbn9d |
| Name |
[(R)-12/(S)]-Pyrene-1-ylcarbamic acid 2-octyl ester |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H27NO2 |
| InChI |
InChI=1S/C25H27NO2/c1-3-4-5-6-8-17(2)28-25(27)26-22-16-14-20-12-11-18-9-7-10-19-13-15-21(22)24(20)23(18)19/h7,9-17H,3-6,8H2,1-2H3,(H,26,27)/t17-/m1/s1 |
| InChIKey |
SXPFNYOYFPJMGE-QGZVFWFLSA-N |
| Molecular Weight |
373.496 g/mol |
| SMILES |
N(C(=O)O[C@@](CCCCCC)(C)[H])c1c2c3c4c(cc2)cccc4ccc3cc1 |
| SPLASH |
splash10-03di-0093000000-b346b863f2e7d0e39424 |
| Source of Spectrum |
QF-9-1931-12 |
| Wiley ID |
1558374 |
![[(R)-12/(S)]-Pyrene-1-ylcarbamic acid 2-octyl ester](/api/spectrum/39ayhjKbn9d/structure.png?h=300&w=458 "[(R)-12/(S)]-Pyrene-1-ylcarbamic acid 2-octyl ester")
