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

125
Patents

116.04082 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 117.048096 121.5
[M+Na]+ 139.030038 128.9
[M-H]- 115.033544 123.8
[M+NH4]+ 134.074643 144.8
[M+K]+ 155.003978 127.6
[M+H-H2O]+ 99.038080 115.7
[M+HCOO]- 161.039021 140.1
[M+CH3COO]- 175.054671 166.8
[M+Na-2H]- 137.015486 124.7
[M]+ 116.04027142 118.7
[M]- 116.04136858 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