Ontology mapping
- Primary identifier
-
CHEBI:17484 - Ontology label
- benzyl isothiocyanate
Synonyms (1)
| Synonym | Type | Source | Occurrences |
|---|---|---|---|
| (isothiocyanatomethyl)benzene | EXACT_SYNONYM | chebi_synonym_review |
Chemical properties
- Cas rn
- 622-78-6
- Data source
- CultureBotHT compounds_to_cas.csv
- Retrieval date
- 2026-04-29T06:04:17.380972+00:00
- Molecular formula
- C8H7NS
- Inchi
- InChI=1S/C8H7NS/c10-7-9-6-8-4-2-1-3-5-8/h1-5H,6H2
- Smiles
- S=C=NCc1ccccc1
Evidence (1)
DATABASE_MATCH
via CultureBotHT
Imported from CultureBotHT.
Occurrence statistics
- Total occurrences
- 0
- Distinct media
- 0
Curation history
| Timestamp | Curator | Action | New status | Changes |
|---|---|---|---|---|
| 2026-04-29T06:04:17.380972+00:00 | audit_integrate_culturebotht | CREATED_FROM_CULTUREBOTHT | MAPPED | Created from CultureBotHT compounds_to_cas.csv (CAS=622-78-6); Imported from CultureBotHT. |
| 2026-05-01T07:35:32.370420+00:00 | auto_classify_ingredient_type | AUTO_CLASSIFY_INGREDIENT_TYPE | set ingredient_type=SINGLE_INGREDIENT (CHEBI primary) | |
| 2026-05-01T08:08:28.179220+00:00 | auto_classify_ingredient_type | AUTO_BACKFILL_CHEBI_CHEMISTRY | molecular_formula=C8H7NS; inchi=InChI=1S/C8H7NS/c10-7-9-6-8-4-2-1-3-5-8/h1-5H,6H2; smiles=S=C=NCc1ccccc1 | |
| 2026-05-02T03:12:12.760334+00:00 | auto_classify_ingredient_type | AUTO_CLASSIFY_INGREDIENT_TYPE | set ingredient_type=SINGLE_INGREDIENT (chemical structure populated (molecular_formula)) |