CID 65130702

1485140-23-5

Structural Information

Molecular Formula
C5H11NS
SMILES
CSC1(CC1)CN
InChI
InChI=1S/C5H11NS/c1-7-5(4-6)2-3-5/h2-4,6H2,1H3
InChIKey
XGGSNZZIPYLUBJ-UHFFFAOYSA-N
Compound name
(1-methylsulfanylcyclopropyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

117.06122 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 118.068496 118.0
[M+Na]+ 140.050438 127.1
[M-H]- 116.053944 122.5
[M+NH4]+ 135.095043 137.6
[M+K]+ 156.024378 125.7
[M+H-H2O]+ 100.058480 113.3
[M+HCOO]- 162.059421 137.2
[M+CH3COO]- 176.075071 173.9
[M+Na-2H]- 138.035886 123.6
[M]+ 117.06067142 120.8
[M]- 117.06176858 120.8
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