SpectraBase Compound ID | IkRDIkZhw9o |
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InChI | InChI=1S/C40H58/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,15-17,19-22,25-31H,13-14,18,23-24,32H2,1-10H3/b12-11+,25-15+,26-16+,31-17+,35-21+,36-22+,37-27+,38-28+,39-29-,40-30- |
InChIKey | ATCICVFRSJQYDV-LDFCOYODSA-N |
Mol Weight | 538.9 g/mol |
Molecular Formula | C40H58 |
Exact Mass | 538.453852 g/mol |
SpectraBase Spectrum ID | 1CGsCjyHjvA |
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Name | Proneurosporene |
CAS Registry Number | 10467-46-6 |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C40H58 |
InChI | InChI=1S/C40H58/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,15-17,19-22,25-31H,13-14,18,23-24,32H2,1-10H3/b12-11+,25-15+,26-16+,31-17+,35-21+,36-22+,37-27+,38-28+,39-29-,40-30- |
InChIKey | ATCICVFRSJQYDV-LDFCOYODSA-N |
Molecular Weight | 538.904 g/mol |
SMILES | C(\C(=C\C=C\C(=C/C=C/C(=C/C=C/C=C/(\C=C\C=C/(CC\C=C\(CCC=C(C)C)C)C)C)C)C)C)CC=C(C)C |
SPLASH | splash10-000i-0000190000-50dd1568dcf2539f0243 |
Source of Spectrum | KC-1983-3018-0 |
Wiley ID | 1404430 |