Services
Research
Training
Industry
About us
ChEBI
Examples:
iron*
,
InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
Advanced
Home
Advanced Search
Browse
Documentation
Download
Tools
About ChEBI
Submit
Contact us
DiNA
Statistics
Entity of the Month
Periodic Table
Ontology
Train online
User Manual
Annotation Manual
Developer Manual
FAQ's
BiNChE
libChEBI
Web Services
ChEBI
> Main
CHEBI:134630 - (2
S
)-2-methylbutanenitrile
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
(2
S
)-2-methylbutanenitrile
ChEBI ID
CHEBI:134630
ChEBI ASCII Name
(2S)-2-methylbutanenitrile
Definition
A 2-methylbutyronitrile that has
S
configuration.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Kristian Axelsen
Supplier Information
Download
Molfile
XML
SDF
Find compounds which contain this structure
Find compounds which resemble this structure
Take structure to the Advanced Search
Formula
C5H9N
Net Charge
0
Average Mass
83.132
Monoisotopic Mass
83.07350
InChI
InChI=1S/C5H9N/c1-3-5(2)4-6/h5H,3H2,1-2H3/t5-/m0/s1
InChIKey
RCEJCSULJQNRQQ-YFKPBYRVSA-N
SMILES
C([C@@H](C#N)C)C
ChEBI Ontology
Outgoing
(2
S
)-2-methylbutanenitrile (
CHEBI:134630
)
is a
2-methylbutanenitrile (
CHEBI:61669
)
IUPAC Name
(2
S
)-2-methylbutanenitrile
Synonyms
Sources
(2
S
)-2-cyanobutane
ChEBI
(2
S
)-2-methylbutanenitrile
ChEBI
(2
S
)-2-methylbutanenitrile
UniProt
(2
S
)-2-methylbutyronitrile
ChEBI
(
S
)-2-cyanobutane
ChEBI
(
S
)-2-methylbutanenitrile
ChEBI
Registry Number
Type
Source
1719849
Reaxys Registry Number
Reaxys
Last Modified
01 March 2017