SpectraBase Spectrum ID |
EdJfHeKs7FK |
Name |
2-[(1S)-3,3,3-trichloro-1-(4-methoxyphenyl)propoxy]adamantane |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C20H25Cl3O2 |
InChI |
InChI=1S/C20H25Cl3O2/c1-24-17-4-2-14(3-5-17)18(11-20(21,22)23)25-19-15-7-12-6-13(9-15)10-16(19)8-12/h2-5,12-13,15-16,18-19H,6-11H2,1H3/t12-,13+,15-,16+,18-,19?/m0/s1 |
InChIKey |
UJHNQYREPKJKJT-KQOSQPDQSA-N |
Instrument Name |
LRMS |
Ionization Type |
EI |
Molecular Weight |
403.777 g/mol |
SMILES |
c1cc(ccc1OC)[C@@](OC1[C@]2(C[C@]3(C[C@@]1(C[C@@](C2)(C3)[H])[H])[H])[H])(CC(Cl)(Cl)Cl)[H] |
SPLASH |
splash10-0079-0940000000-fab4e5214aeb2f1f3472 |
Source of Spectrum |
CN112778068A |
Wiley ID |
1879854 |