CID 84762920

2839144-69-1

Structural Information

Molecular Formula
C7H15NS
SMILES
CCSCC1(CC1)CN
InChI
InChI=1S/C7H15NS/c1-2-9-6-7(5-8)3-4-7/h2-6,8H2,1H3
InChIKey
VVLXMAWHAYBPOD-UHFFFAOYSA-N
Compound name
[1-(ethylsulfanylmethyl)cyclopropyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

145.09251 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.09979 126.0
[M+Na]+ 168.08173 134.3
[M-H]- 144.08523 130.1
[M+NH4]+ 163.12633 144.5
[M+K]+ 184.05567 132.3
[M+H-H2O]+ 128.08977 121.0
[M+HCOO]- 190.09071 144.6
[M+CH3COO]- 204.10636 179.7
[M+Na-2H]- 166.06718 130.6
[M]+ 145.09196 129.4
[M]- 145.09306 129.4
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.