SpectraBase Spectrum ID |
H22q0hnuAUb |
Name |
1,3,5-trimethyl-7-(3,5,7-trimethyl-1-adamantyl)adamantane |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C26H42 |
InChI |
InChI=1S/C26H42/c1-19-7-20(2)9-21(3,8-19)15-25(13-19,14-20)26-16-22(4)10-23(5,17-26)12-24(6,11-22)18-26/h7-18H2,1-6H3/t19-,20+,21?,22-,23+,24?,25-,26- |
InChIKey |
FHMNBZGPQXHCKS-VWLNATRRSA-N |
Molecular Weight |
354.622 g/mol |
SMILES |
[C@]12([C@]34C[C@@]5(C)CC(C4)(C[C@@](C3)(C5)C)C)C[C@@]3(C)C[C@@](C2)(CC(C1)(C3)C)C |
SPLASH |
splash10-004i-0901000000-fdf58e73f6228f588a95 |
Source of Spectrum |
KC-1977-505-510 |
Wiley ID |
1345055 |