| SpectraBase Spectrum ID |
B1aNSeFEREm |
| Name |
Catechin-7-O-glucoside, octa-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 |
1028.448075923 u |
| Formula |
C45H88O11Si8 |
| GC Column |
HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness) |
| InChI |
InChI=1S/C45H88O11Si8/c1-57(2,3)46-31-40-42(54-62(16,17)18)43(55-63(19,20)21)44(56-64(22,23)24)45(49-40)47-33-28-36-34(37(29-33)51-59(7,8)9)30-39(53-61(13,14)15)41(48-36)32-25-26-35(50-58(4,5)6)38(27-32)52-60(10,11)12/h25-29,39-45H,30-31H2,1-24H3 |
| InChIKey |
QDILEWUZWFRDNW-UHFFFAOYSA-N |
| Molecular Weight |
1029.868 g/mol |
| Nominal Mass |
1028 u |
| Number of Peaks |
430 |
| SMILES |
C1(OC(C(C(C1O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)CO[Si](C)(C)C)Oc1cc(c2CC(O[Si](C)(C)C)C(Oc2c1)c1cc(c(cc1)O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C |
| SPLASH |
splash10-00kb-1139000000-5356e8bcac08698692d8 |
| Source |
birch (B. pubescens) buds |
| Source of Spectrum |
Biologically and Environmentally Important Organic Compounds: GCMS Library |
| Wiley ID |
VI001518 |
