| SpectraBase Spectrum ID |
B2hzPNuvWzY |
| Name |
Isosalipurposide, hepta-TMS |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
938.397984447 u |
| Formula |
C42H78O10Si7 |
| GC Column |
HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness) |
| InChI |
InChI=1S/C42H78O10Si7/c1-53(2,3)44-30-37-39(50-57(13,14)15)40(51-58(16,17)18)41(52-59(19,20)21)42(46-37)45-35-28-33(48-55(7,8)9)29-36(49-56(10,11)12)38(35)34(43)27-24-31-22-25-32(26-23-31)47-54(4,5)6/h22-29,37,39-42H,30H2,1-21H3/b27-24+ |
| InChIKey |
PNUMDSCUUSFWSU-SOYKGTTHSA-N |
| Molecular Weight |
939.671 g/mol |
| Nominal Mass |
938 u |
| Number of Peaks |
571 |
| SMILES |
c1cc(ccc1\C=C\C(c1c(cc(cc1OC1OC(C(C(C1O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)CO[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)=O)O[Si](C)(C)C |
| SPLASH |
splash10-00xs-8793230000-5ee84d992127a6fc35dc |
| Source |
L. Poblocka-Olech |
| Source of Spectrum |
Biologically and Environmentally Important Organic Compounds: GCMS Library |
| Synonyms |
Chalcononarigenin 2'-glucoside, hepta-TMS |
| Wiley ID |
VI001906 |
