CID 207807

2(1h)-pyrimidinethione, tetrahydro-1,3-dipropyl-

Structural Information

Molecular Formula
C10H20N2S
SMILES
CCCN1CCCN(C1=S)CCC
InChI
InChI=1S/C10H20N2S/c1-3-6-11-8-5-9-12(7-4-2)10(11)13/h3-9H2,1-2H3
InChIKey
FWTLMXBRDIEOJQ-UHFFFAOYSA-N
Compound name
1,3-dipropyl-1,3-diazinane-2-thione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

200.13472 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.14200 148.2
[M+Na]+ 223.12394 159.0
[M+NH4]+ 218.16854 156.5
[M+K]+ 239.09788 149.9
[M-H]- 199.12744 149.4
[M+Na-2H]- 221.10939 151.5
[M]+ 200.13417 150.4
[M]- 200.13527 150.4
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.