CID 156056950

2763740-80-1

Structural Information

Molecular Formula
C7H15NS
SMILES
CSCCC1CC(C1)N
InChI
InChI=1S/C7H15NS/c1-9-3-2-6-4-7(8)5-6/h6-7H,2-5,8H2,1H3
InChIKey
VEEJBWQNNYOIHV-UHFFFAOYSA-N
Compound name
3-(2-methylsulfanylethyl)cyclobutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

145.09251 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.099786 128.0
[M+Na]+ 168.081728 132.5
[M-H]- 144.085234 130.8
[M+NH4]+ 163.126333 142.9
[M+K]+ 184.055668 133.7
[M+H-H2O]+ 128.089770 116.8
[M+HCOO]- 190.090711 144.5
[M+CH3COO]- 204.106361 180.7
[M+Na-2H]- 166.067176 129.3
[M]+ 145.09196142 135.8
[M]- 145.09305858 135.8
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

patents stripe