CID 3034720

Thiourea, (methoxymethyl)-

Structural Information

Molecular Formula
C3H8N2OS
SMILES
COCNC(=S)N
InChI
InChI=1S/C3H8N2OS/c1-6-2-5-3(4)7/h2H2,1H3,(H3,4,5,7)
InChIKey
VHHBCZRHMHRNTP-UHFFFAOYSA-N
Compound name
methoxymethylthiourea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

58
Patents

120.035736 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 121.04301 122.8
[M+Na]+ 143.02495 130.6
[M+NH4]+ 138.06956 130.8
[M+K]+ 158.99889 124.7
[M-H]- 119.02846 123.0
[M+Na-2H]- 141.01040 125.7
[M]+ 120.03519 124.0
[M]- 120.03628 124.0
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