COMPOUND: C03647
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Entry
C03647 Compound
Name
cis,trans-Hexadienedioate
Formula
C6H6O4
Exact mass
142.0266
Mol weight
142.1094
Structure
Mol file
KCF file
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Other DBs
PubChem:
6428
ChEBI:
27671
NIKKAJI:
J784.052G
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KCF data
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ATOM 10
1 C6a C 20.2775 -16.5184
2 C2b C 19.0675 -17.2201
3 O6a O 21.4942 -17.2201
4 O6a O 20.2775 -15.1217
5 C2b C 17.8573 -16.5184
6 C2b C 17.8573 -15.1217
7 C2b C 16.6407 -14.4200
8 C6a C 16.6407 -13.0168
9 O6a O 17.8573 -12.3216
10 O6a O 15.4305 -12.3216
BOND 9
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 2
5 5 6 1
6 6 7 2
7 7 8 1
8 8 9 1
9 8 10 2
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