CID 10084702
Juglomycin a
Structural Information
- Molecular Formula
- C14H10O6
- SMILES
- C1[C@H]([C@H](OC1=O)C2=CC(=O)C3=C(C2=O)C=CC=C3O)O
- InChI
- InChI=1S/C14H10O6/c15-8-3-1-2-6-12(8)9(16)4-7(13(6)19)14-10(17)5-11(18)20-14/h1-4,10,14-15,17H,5H2/t10-,14-/m1/s1
- InChIKey
- JUTDGBUUAXODBT-QMTHXVAHSA-N
- Compound name
- 5-hydroxy-2-[(2R,3R)-3-hydroxy-5-oxooxolan-2-yl]naphthalene-1,4-dione
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 275.05501 | 154.5 |
[M+Na]+ | 297.03695 | 164.3 |
[M-H]- | 273.04045 | 161.3 |
[M+NH4]+ | 292.08155 | 171.3 |
[M+K]+ | 313.01089 | 161.7 |
[M+H-H2O]+ | 257.04499 | 149.3 |
[M+HCOO]- | 319.04593 | 172.9 |
[M+CH3COO]- | 333.06158 | 194.0 |
[M+Na-2H]- | 295.02240 | 156.7 |
[M]+ | 274.04718 | 155.0 |
[M]- | 274.04828 | 155.0 |
Literature stripe
Patent stripe
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