COMPOUND: C02420
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Entry
C02420 Compound
Name
Isobutyronitrile;
2-Methylpropanenitrile
Formula
C4H7N
Exact mass
69.0578
Mol weight
69.11
Structure
Mol file
KCF file
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Reaction
R11641
R11642
Enzyme
1.14.14.41
Other DBs
CAS:
78-82-0
PubChem:
5451
ChEBI:
28638
NIKKAJI:
J1.959C
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KCF data
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ATOM 5
1 C1c C 17.7811 -14.7666
2 C3b C 18.9969 -14.0720
3 C1a C 16.5721 -14.0655
4 C1a C 17.7811 -16.1687
5 N3a N 20.2124 -13.3772
BOND 4
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 3
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