CID 124707279

3-(1,3-benzothiazol-2-yl)oxetan-3-amine hydrochloride

Structural Information

Molecular Formula
C10H10N2OS
SMILES
C1C(CO1)(C2=NC3=CC=CC=C3S2)N
InChI
InChI=1S/C10H10N2OS/c11-10(5-13-6-10)9-12-7-3-1-2-4-8(7)14-9/h1-4H,5-6,11H2
InChIKey
IFCMHBRMYHZZEZ-UHFFFAOYSA-N
Compound name
3-(1,3-benzothiazol-2-yl)oxetan-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

206.05139 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.05867 132.6
[M+Na]+ 229.04061 140.8
[M+NH4]+ 224.08521 139.8
[M+K]+ 245.01455 135.2
[M-H]- 205.04411 135.2
[M+Na-2H]- 227.02606 139.0
[M]+ 206.05084 134.0
[M]- 206.05194 134.0
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

No patent data available for this compound.