SpectraBase Spectrum ID |
9RqiMjEGXCD |
Name |
3-Benzoyloxy-2-undecyl-tricyclo[7.5.2.1(5,8).0(4,9)]deca-1,6-diene. |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C28H38O2 |
InChI |
InChI=1S/C28H38O2/c1-2-3-4-5-6-7-8-9-11-16-24-20-25-22-17-18-23(19-22)26(25)27(24)30-28(29)21-14-12-10-13-15-21/h10,12-15,17-18,20,22-23,25-27H,2-9,11,16,19H2,1H3/t22-,23+,25+,26-,27-/m1/s1 |
InChIKey |
CQCQKQHPUWFCNZ-BDYXOVRASA-N |
Molecular Weight |
406.610 g/mol |
SMILES |
[C@]1([C@]2([C@]([C@]3(C[C@@]2(C=C3)[H])[H])(C=C1CCCCCCCCCCC)[H])[H])(OC(=O)c1ccccc1)[H] |
SPLASH |
splash10-0a4i-0900000000-0cd933a61907f887efe4 |
Source of Spectrum |
D1-2000-1020-8 |
Synonyms |
(S)-3-Benzoyloxy-2-undecyl-tricyclo[7.5.2.1(5,8).0(4,9)]deca-1,6-diene.
4-undecyltricyclo[5.2.1.0(2,6)]deca-4,8-dien-3-yl benzoate |
Wiley ID |
835422 |