RSC
SyntheticPages
Login
Register
About
What is ChemSpider?
ChemSpider Blog
Data Sources
The Team
Advisory Group
Collaborators
Present Sponsors
Sponsor ChemSpider
Advertise
More Searches
Simple search
Structure search
Advanced search
Search History
Web APIs
Help
FAQ
Help
Getting Started
Forum
SiteMap
Search
Simple
Structure
Advanced
Intrinsic properties
More searches...
Ligand screening
Chemical elements
Intrinsic properties
Predicted properties
Data slice
Supplementary Information
Molecular Formula:
Define range intervals using parentheses.
E.g. C7H(10-14)O(0-4)
Molecular Weight:
±
(example: 123 ± 1)
min/max
+/-
Nominal Mass:
±
-2H+
-H+
+H+
+2H+
min/max
+/-
Average Mass:
±
M+CH3CNH
M+CH3OH2
M+.
M+K
M+Na
M+NH4
M+H
M-H
M+acetate
M-.
M+Cl
-e
+e
min/max
+/-
Monoisotopic Mass:
±
M+CH3CNH
M+CH3OH2
M+.
M+K
M+Na
M+NH4
M+H
M-H
M+acetate
M-.
M+Cl
-e
+e
min/max
+/-
Options
Single/Multi-component
Search Any
Search Single-Component Structures Only
Search Multi-Component Structures Only
Isotopically Labeled
Search Any
Search Isotopically Labeled Structures Only
Disregard Isotopically Labeled Structures
Additional Filters
Filter only those having analytical data
Search
Search Hits Limit:
10
100
1000
10000
Loading ...
100 hits returned from a total of 464.
Search terms:
MF = 'C_{6}H_{12}O_{2}'
Grid
Tile
Table
Names/Structures
Names
1
2
3
4
5
ID
Structure
Molecular Formula
Molecular Weight
# of Data Sources
# of References
# of PubMed
# of RSC
8552
zoom
C
6
H
12
O
2
116.1583
89
356
444
436
12067
zoom
C
6
H
12
O
2
116.1583
78
160
85
192
13438
zoom
C
6
H
12
O
2
116.1583
71
91
0
39
29012
zoom
C
6
H
12
O
2
116.1583
65
321
377
781
7475
zoom
C
6
H
12
O
2
116.1583
63
193
182
285
2053988
zoom
C
6
H
12
O
2
116.1583
61
75
0
2
7747
zoom
C
6
H
12
O
2
116.1583
60
98
18
110
6649
zoom
C
6
H
12
O
2
116.1583
59
108
0
6
7065
zoom
C
6
H
12
O
2
116.1583
59
96
28
113
10446
zoom
C
6
H
12
O
2
116.1583
59
101
28
150
11193
zoom
C
6
H
12
O
2
116.1583
58
80
5
21
7469
- 0/1 defined
zoom
C
6
H
12
O
2
116.1583
58
91
19
87
10689
- 0/2 defined
zoom
C
6
H
12
O
2
116.1583
53
82
20
114
13838151
zoom
C
6
H
12
O
2
116.1583
52
92
29
252
7064
- 0/1 defined
zoom
C
6
H
12
O
2
116.1583
51
75
4
250
7761
zoom
C
6
H
12
O
2
116.1583
47
62
0
30
10687
zoom
C
6
H
12
O
2
116.1583
46
71
0
22
7472
- 0/1 defined
zoom
C
6
H
12
O
2
116.1583
45
76
4
38
7243
- 0/1 defined
zoom
C
6
H
12
O
2
116.1583
45
58
2
15
11706
zoom
C
6
H
12
O
2
116.1583
44
60
16
75
1
2
3
4
5
Generate Leads
Advertise
Sponsor
Advertisements
Also from the RSC