CID 135477871

4,5-dihydro-n-methyl-2-thiazolamine monohydrobromide

Structural Information

Molecular Formula
C4H8N2S
SMILES
CN=C1NCCS1
InChI
InChI=1S/C4H8N2S/c1-5-4-6-2-3-7-4/h2-3H2,1H3,(H,5,6)
InChIKey
KOFXNMVSVWDBKN-UHFFFAOYSA-N
Compound name
N-methyl-1,3-thiazolidin-2-imine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

116
Patents

116.04082 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 117.04810 121.5
[M+Na]+ 139.03004 128.9
[M-H]- 115.03354 123.8
[M+NH4]+ 134.07464 144.8
[M+K]+ 155.00398 127.6
[M+H-H2O]+ 99.038080 115.7
[M+HCOO]- 161.03902 140.1
[M+CH3COO]- 175.05467 166.8
[M+Na-2H]- 137.01549 124.7
[M]+ 116.04027 118.7
[M]- 116.04137 118.7
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