CID 3059155

76175-45-6

Structural Information

Molecular Formula
C8H11NOS
SMILES
C1COC(CN1)C2=CC=CS2
InChI
InChI=1S/C8H11NOS/c1-2-8(11-5-1)7-6-9-3-4-10-7/h1-2,5,7,9H,3-4,6H2
InChIKey
PBAULEGLRQCXKD-UHFFFAOYSA-N
Compound name
2-thiophen-2-ylmorpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

169.05614 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.063416 133.3
[M+Na]+ 192.045358 139.9
[M-H]- 168.048864 137.7
[M+NH4]+ 187.089963 152.6
[M+K]+ 208.019298 138.2
[M+H-H2O]+ 152.053400 127.4
[M+HCOO]- 214.054341 148.0
[M+CH3COO]- 228.069991 146.0
[M+Na-2H]- 190.030806 136.1
[M]+ 169.05559142 130.0
[M]- 169.05668858 130.0
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

patents stripe