CID 6273694

Nsc683513

Structural Information

Molecular Formula
C11H10N2OS
SMILES
CC1=C(SC2=C1/C(=N/O)/C3=CC=CN32)C
InChI
InChI=1S/C11H10N2OS/c1-6-7(2)15-11-9(6)10(12-14)8-4-3-5-13(8)11/h3-5,14H,1-2H3/b12-10+
InChIKey
YYUGVXBVYQBTQG-ZRDIBKRKSA-N
Compound name
(NZ)-N-(2,3-dimethylthieno[3,2-b]pyrrolizin-4-ylidene)hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

218.05139 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.058666 147.1
[M+Na]+ 241.040608 161.2
[M-H]- 217.044114 154.2
[M+NH4]+ 236.085213 173.5
[M+K]+ 257.014548 157.7
[M+H-H2O]+ 201.048650 143.7
[M+HCOO]- 263.049591 169.9
[M+CH3COO]- 277.065241 162.8
[M+Na-2H]- 239.026056 148.5
[M]+ 218.05084142 154.5
[M]- 218.05193858 154.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.