CID 58278

Formamidine, n'-4-(4h-1-benzothiopyranyl)-n,n-dimethyl-

Structural Information

Molecular Formula
C12H14N2S
SMILES
CN(C)C=NC1C=CSC2=CC=CC=C12
InChI
InChI=1S/C12H14N2S/c1-14(2)9-13-11-7-8-15-12-6-4-3-5-10(11)12/h3-9,11H,1-2H3
InChIKey
FMHAVXBMZHXZLJ-UHFFFAOYSA-N
Compound name
N,N-dimethyl-N'-(4H-thiochromen-4-yl)methanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

218.08777 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.095046 145.0
[M+Na]+ 241.076988 152.0
[M-H]- 217.080494 152.0
[M+NH4]+ 236.121593 165.9
[M+K]+ 257.050928 149.4
[M+H-H2O]+ 201.085030 138.0
[M+HCOO]- 263.085971 166.0
[M+CH3COO]- 277.101621 197.2
[M+Na-2H]- 239.062436 151.0
[M]+ 218.08722142 146.9
[M]- 218.08831858 146.9
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.