COMPOUND: C07327
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Entry
C07327 Compound
Name
3-Pyridinaldehyde;
Pyridine-3-aldehyde;
3-Pyridinecarboxaldehyde;
Nicotinaldehyde
Formula
C6H5NO
Exact mass
107.0371
Mol weight
107.11
Structure
Mol file
KCF file
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CAS:
500-22-1
PubChem:
9535
ChEBI:
28345
NIKKAJI:
J28.015A
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KCF data
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ATOM 8
1 C8y C 27.9877 -19.1952
2 C8x C 26.7758 -19.8978
3 C8x C 29.1997 -19.8978
4 C4a C 27.9936 -17.7958
5 C8x C 26.7758 -21.2973
6 N5x N 29.1997 -21.2973
7 O4a O 29.2057 -17.0990
8 C8x C 27.9877 -21.9999
BOND 8
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 2
5 3 6 1
6 4 7 2
7 5 8 1
8 6 8 2
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