CID 61330275

4-(1,3-thiazol-2-yl)oxan-4-amine

Structural Information

Molecular Formula
C8H12N2OS
SMILES
C1COCCC1(C2=NC=CS2)N
InChI
InChI=1S/C8H12N2OS/c9-8(1-4-11-5-2-8)7-10-3-6-12-7/h3,6H,1-2,4-5,9H2
InChIKey
WNIZZYWWSGQBKU-UHFFFAOYSA-N
Compound name
4-(1,3-thiazol-2-yl)oxan-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

184.06703 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.074306 136.2
[M+Na]+ 207.056248 143.1
[M-H]- 183.059754 141.6
[M+NH4]+ 202.100853 156.9
[M+K]+ 223.030188 141.9
[M+H-H2O]+ 167.064290 130.2
[M+HCOO]- 229.065231 152.7
[M+CH3COO]- 243.080881 149.1
[M+Na-2H]- 205.041696 140.4
[M]+ 184.06648142 133.3
[M]- 184.06757858 133.3
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.