| SpectraBase Spectrum ID |
Jww48dMECyr |
| Name |
cystine, 3TMS |
| Alternate Name(s) |
cytidine, 3TMS
cytarabine, 3TMS
Arabinocytidine, 3TMS
Cytarabinoside, 3TMS
Spongocytidine, 3TMS
Aracytidine, 3TMS
4-Amino-1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one, 3TMS
4-Amino-1-(3,4-bis((trimethylsilyl)oxy)-5-(((trimethylsilyl)oxy)methyl)tetrahydrofuran-2-yl)pyrimidin-2(1H)-one |
| Comments |
Derivatization type: 3 TMS (mass: 459.204); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000131; Note: The molecular formula of the structure shown is C9H13N3O5 - which differs from the formula reported for the mass spectrum (C18H37N3O5Si3) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H37N3O5Si3 |
| InChI |
InChI=1S/C18H37N3O5Si3/c1-27(2,3)23-12-13-15(25-28(4,5)6)16(26-29(7,8)9)17(24-13)21-11-10-14(19)20-18(21)22/h10-11,13,15-17H,12H2,1-9H3,(H2,19,20,22) |
| InChIKey |
NATBOBHUVCMNTD-UHFFFAOYSA-N |
| Molecular Weight |
459.765 g/mol |
| SMILES |
NC=1C=CN(C2C(C(C(CO[Si](C)(C)C)O2)O[Si](C)(C)C)O[Si](C)(C)C)C(N1)=O |
| SPLASH |
splash10-0fr2-1930000000-95438474260d8bfabd89 |
| Source of Spectrum |
FM-2019-131-0 |
| Wiley ID |
1817824 |
