SpectraBase Spectrum ID |
ECqx7qWacyv |
Name |
(1R)-4-[(1E,3E,5E,7E,11E,13E,15E,17E,19E)-3,7,12,16,20,24-hexamethylpentacosa-1,3,5,7,11,13,15,17,19,23-decaen-9-ynyl]-3,5,5-trimethyl-1-cyclohex-3-enol |
CAS Registry Number |
86004-69-5 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C40H54O |
InChI |
InChI=1S/C40H54O/c1-31(2)17-13-20-34(5)23-15-25-35(6)24-14-21-32(3)18-11-12-19-33(4)22-16-26-36(7)27-28-39-37(8)29-38(41)30-40(39,9)10/h14-19,21-28,38,41H,13,20,29-30H2,1-10H3/b21-14+,22-16+,25-15+,28-27+,32-18+,33-19+,34-23+,35-24+,36-26+/t38-/m1/s1 |
InChIKey |
FOBXZQPXXVZBDZ-JQIGKHAGSA-N |
Molecular Weight |
550.871 g/mol |
SMILES |
O[C@]1(CC(C(=C(C1)C)\C=C\C(=C\C=C\C(=C\C#C\C=C\(\C=C\C=C\(\C=C\C=C\(CCC=C(C)C)C)C)C)C)C)(C)C)[H] |
SPLASH |
splash10-014i-9000000000-f70d84b8f67be5371840 |
Source of Spectrum |
H-66-511-0 |
Synonyms |
(1R)-4-[(1E,3E,5E,7E,11E,13E,15E,17E,19E)-3,7,12,16,20,24-hexamethylpentacosa-1,3,5,7,11,13,15,17,19,23-decaen-9-ynyl]-3,5,5-trimethyl-cyclohex-3-en-1-ol |
Wiley ID |
1405806 |