| SpectraBase Spectrum ID |
5Q31ep9TCGy |
| Name |
Linarin, 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 |
1096.455893245 u |
| Formula |
C49H88O14Si7 |
| GC Column |
HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness) |
| InChI |
InChI=1S/C49H88O14Si7/c1-32-42(58-65(6,7)8)44(60-67(12,13)14)46(62-69(18,19)20)48(53-32)52-31-40-43(59-66(9,10)11)45(61-68(15,16)17)47(63-70(21,22)23)49(56-40)54-35-28-38-41(39(29-35)57-64(3,4)5)36(50)30-37(55-38)33-24-26-34(51-2)27-25-33/h24-30,32,40,42-49H,31H2,1-23H3 |
| InChIKey |
YALGJYSFZGFTPF-UHFFFAOYSA-N |
| Molecular Weight |
1097.824 g/mol |
| Nominal Mass |
1096 u |
| Number of Peaks |
157 |
| SMILES |
C1(OC(C(C(C1O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)OCC1OC(C(C(C1O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)Oc1cc(c2c(c1)OC(=CC2=O)c1ccc(cc1)OC)O[Si](C)(C)C)C |
| SPLASH |
splash10-096r-1489000000-83e1b87f3e5a7cf27b5b |
| Source |
J. Nazaruk; Cirsium rivulare |
| Source of Spectrum |
Biologically and Environmentally Important Organic Compounds: GCMS Library |
| Synonyms |
Acacetin 7-O-rutinoside, hepta-TMS |
| Wiley ID |
VI001501 |
