COMPOUND: C10899
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Entry
C10899 Compound
Name
Allophanic acid methyl ester;
Allophanic acid, methyl ester;
1-(Methoxycarbonyl)urea
Formula
C3H6N2O3
Exact mass
118.0378
Mol weight
118.0913
Structure
Mol file
KCF file
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CAS:
761-89-7
PubChem:
13082
ChEBI:
2600
NIKKAJI:
J55.358A
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KCF data
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ATOM 8
1 N1a N 15.8200 -20.2300
2 C5a C 17.0324 -19.5300
3 N1b N 18.2449 -20.2300
4 C7a C 19.4573 -19.5300
5 O7a O 20.6697 -20.2300
6 C1a C 21.8822 -19.5300
7 O5a O 17.0324 -18.1302
8 O6a O 19.4573 -18.1300
BOND 7
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 2 7 2
7 4 8 2
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