Jump to main content
Jump to site nav
Home
About us
Membership & professional community
Campaigning & outreach
Journals, books & databases
Teaching & learning
News & events
Locations & contacts
Home
About us
Web APIs
Help
Sign in
ChemSpider
Search and share chemistry
Simple
Structure
Advanced
History
Molecular Formula:
Define range intervals using parentheses.
E.g. C7H(10-14)O(0-4)
Molecular Weight:
to
±
(example: 123 ± 1)
min/max
+/-
Nominal Mass:
to
±
-2H+
-H+
+H+
+2H+
min/max
+/-
Average Mass:
to
±
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:
to
±
M+CH3CNH
M+CH3OH2
M+.
M+K
M+Na
M+NH4
M+H
M-H
M+acetate
M-.
M+Cl
-e
+e
min/max
+/-
Search
Search Hits Limit:
100
1000
10000
Filter
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
Found 955 results
Search term:
MF = 'C_{6}H_{8}N_{2}O_{2}S'
1
2
3
4
5
ID
Structure
Molecular Formula
Molecular Weight
# of Data Sources
# of References
# of PubMed
# of RSC
5142
zoom
C
6
H
8
N
2
O
2
S
172.2049
189
2203
1300
459
65971
zoom
C
6
H
8
N
2
O
2
S
172.2049
170
103
0
3
278337
zoom
C
6
H
8
N
2
O
2
S
172.2049
160
82
0
2
65726
zoom
C
6
H
8
N
2
O
2
S
172.2049
138
106
3
2
7099
zoom
C
6
H
8
N
2
O
2
S
172.2049
133
95
1
445
622597
zoom
C
6
H
8
N
2
O
2
S
172.2049
125
68
0
0
59146
zoom
C
6
H
8
N
2
O
2
S
172.2049
104
113
7
625
645058
zoom
C
6
H
8
N
2
O
2
S
172.2049
100
64
0
0
2039633
zoom
C
6
H
8
N
2
O
2
S
172.2049
98
67
0
0
2849464
zoom
C
6
H
8
N
2
O
2
S
172.2049
90
55
0
0
963011
zoom
C
6
H
8
N
2
O
2
S
172.2049
90
56
0
0
2042225
- 1/1 defined
zoom
C
6
H
8
N
2
O
2
S
172.2049
89
60
0
0
614522
zoom
C
6
H
8
N
2
O
2
S
172.2049
88
62
0
0
10558702
zoom
C
6
H
8
N
2
O
2
S
172.2049
85
46
0
0
2018009
zoom
C
6
H
8
N
2
O
2
S
172.20492
80
58
0
0
2099442
zoom
C
6
H
8
N
2
O
2
S
172.20492
79
63
0
0
2043992
zoom
C
6
H
8
N
2
O
2
S
172.20492
76
53
0
0
835526
zoom
C
6
H
8
N
2
O
2
S
172.2049
73
49
0
0
648727
zoom
C
6
H
8
N
2
O
2
S
172.2049
72
47
0
0
197618
zoom
C
6
H
8
N
2
O
2
S
172.2049
65
39
0
0
1
2
3
4
5
Advertisement
Advertisement
Spotlight
Advertisement