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

21
Patents

117.06122 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 118.06850 118.0
[M+Na]+ 140.05044 127.1
[M-H]- 116.05394 122.5
[M+NH4]+ 135.09504 137.6
[M+K]+ 156.02438 125.7
[M+H-H2O]+ 100.05848 113.3
[M+HCOO]- 162.05942 137.2
[M+CH3COO]- 176.07507 173.9
[M+Na-2H]- 138.03589 123.6
[M]+ 117.06067 120.8
[M]- 117.06177 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