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]+ 185.07431 136.2
[M+Na]+ 207.05625 143.1
[M-H]- 183.05975 141.6
[M+NH4]+ 202.10085 156.9
[M+K]+ 223.03019 141.9
[M+H-H2O]+ 167.06429 130.2
[M+HCOO]- 229.06523 152.7
[M+CH3COO]- 243.08088 149.1
[M+Na-2H]- 205.04170 140.4
[M]+ 184.06648 133.3
[M]- 184.06758 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.