Fix capitalisation of InChIKey property

Closes #318
MassBank · Dec 2, 2022 · bc3eae7 · bc3eae7
1 parent 8adfb07
commit bc3eae7
Showing 1 changed file with 2 additions and 2 deletions.
diff --git a/MassBank-Project/MassBank-lib/src/main/java/massbank/Record.java b/MassBank-Project/MassBank-lib/src/main/java/massbank/Record.java
@@ -755,7 +755,7 @@ public String createStructuredData() {
 		molecularEntity.addProperty("molecularFormula", CH_FORMULA());
 		molecularEntity.addProperty("description", description);
 		molecularEntity.addProperty("monoisotopicMolecularWeight", CH_EXACT_MASS());
-		if (InChiKey!=null) molecularEntity.addProperty("inchikey", InChiKey);
+		if (InChiKey!=null) molecularEntity.addProperty("inChIKey", InChiKey);
 		if (CH_NAME().size() == 1)  molecularEntity.addProperty("alternateName", CH_NAME().get(0));
 		else if (CH_NAME().size() >= 1) molecularEntity.add("alternateName", gson.toJsonTree(CH_NAME()));
 
@@ -842,4 +842,4 @@ private static Map<String, String> listToMap(List<Pair<String, String>> list) {
 		for (Pair<String, String> pair : list) map.put(pair.getKey(), pair.getValue());
 		return map;		
 	}
-}
+}