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ChemSpider
Search and share chemistry
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Structure
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Matches any text strings used to describe a molecule.
Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID
Systematic names
1,2-dihydroxybenzene
Synonyms
AIBN
Trade names
Aspirin
Registry numbers
7732-18-5
SMILES
O=C(OCC)C
InChl
InChI=1/CH4/h1H4
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Filter only those having analytical data
Found 8 results
Search term:
MLDQJTXFUGDVEO
(Found by InChIKey (skeleton match))
ID
Structure
Molecular Formula
Molecular Weight
# of Data Sources
# of References
# of PubMed
# of RSC
187440
zoom
C
21
H
16
ClF
3
N
4
O
3
464.8249
160
194
1768
9
23937167
zoom
C
21
H
13
D
3
ClF
3
N
4
O
3
467.8434
25
26
0
0
67865831
zoom
C
21
H
12
D
4
ClF
3
N
4
O
3
468.8496
6
8
0
0
34559677
zoom
C
20
13
CH
13
D
3
ClF
3
N
4
O
3
468.8361
4
2
0
0
26345653
zoom
C
20
11
CH
16
ClF
3
N
4
O
3
463.8257
2
2
0
0
10018016
zoom
C
20
14
CH
16
ClF
3
N
4
O
3
466.8175
2
1
0
0
10018017
zoom
C
21
H
13
D
3
ClF
3
N
3
15
NO
3
468.8368
2
1
0
0
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