(Q27126998)

propyl pyrraline (English)

6 October 2016

chemical formula

C₉H₁₃NO₂

1 reference

propyl pyrraline (English)

6 October 2016

canonical SMILES

CCCN1C(=CC=C1C=O)CO

1 reference

propyl pyrraline (English)

InChI=1S/C9H13NO2/c1-2-5-10-8(6-11)3-4-9(10)7-12/h3-4,6,12H,2,5,7H2,1H3

6 October 2016

Identifiers

InChI

1 reference

propyl pyrraline (English)

6 October 2016

2 references

propyl pyrraline (English)

6 October 2016

stated in

ChEBI release 2020-09-01

2 references

1-propylpyrraline (English)

6 October 2016

https://commonchemistry.cas.org/detail?cas_rn=120550-44-9

8 April 2021

1 reference

5-(Hydroxymethyl)-1-propyl-1H-pyrrole-2-carbaldehyde (English)

6 October 2016

2 references

propyl pyrraline (English)

matched by identifier from

6 October 2016

Reaxys registry number

7020681

1 reference

1-propylpyrraline (English)

6 October 2016

ChEBI ID

59972

mapping relation type

2 references

1-propylpyrraline (English)

matched by identifier from

6 October 2016

International Chemical Identifier

InChI

InChI=1S/C9H13NO2/c1-2-5-10-8(6-11)3-4-9(10)7-12/h3-4,6,12H,2,5,7H2,1H3

1 reference

2 references

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

matched by identifier from

DSSTOX compound identifier

0 references

1 reference

Immune Epitope Database and Analysis Resource

IEDB Epitope ID

136027