SpectraBase Spectrum ID |
7CYjueUeJjM |
Name |
(+)-Usnic acid |
CAS Registry Number |
125-46-2 |
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 |
344.089602848 u |
Formula |
C18H16O7 |
GC Column |
HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness) |
InChI |
InChI=1S/C18H16O7/c1-6-14(22)12(8(3)20)16-13(15(6)23)18(4)10(25-16)5-9(21)11(7(2)19)17(18)24/h5,11,22-23H,1-4H3/t11?,18-/m0/s1 |
InChIKey |
CUCUKLJLRRAKFN-MCEAHNFKSA-N |
Molecular Weight |
344.319 g/mol |
Nominal Mass |
344 u |
Number of Peaks |
250 |
SMILES |
Oc1c(c2OC=3[C@@](c2c(O)c1C)(C(C(C(C3)=O)C(=O)C)=O)C)C(=O)C |
SPLASH |
splash10-001i-1192000000-5356bbd9c52ba84bf8e0 |
Source |
Cladonia arbuscula |
Source of Spectrum |
Biologically and Environmentally Important Organic Compounds: GCMS Library |
Wiley ID |
VI001051 |