CID 16793953

N-methylthiolan-3-amine

Structural Information

Molecular Formula
C5H11NS
SMILES
CNC1CCSC1
InChI
InChI=1S/C5H11NS/c1-6-5-2-3-7-4-5/h5-6H,2-4H2,1H3
InChIKey
ZRMIZYDPXOJIRT-UHFFFAOYSA-N
Compound name
N-methylthiolan-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

117.06122 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 118.06850 123.1
[M+Na]+ 140.05044 132.1
[M+NH4]+ 135.09504 133.3
[M+K]+ 156.02438 125.9
[M-H]- 116.05394 125.8
[M+Na-2H]- 138.03589 127.8
[M]+ 117.06067 125.4
[M]- 117.06177 125.4
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

patents stripe