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

15
Patents

169.05614 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.06342 133.3
[M+Na]+ 192.04536 139.9
[M-H]- 168.04886 137.7
[M+NH4]+ 187.08996 152.6
[M+K]+ 208.01930 138.2
[M+H-H2O]+ 152.05340 127.4
[M+HCOO]- 214.05434 148.0
[M+CH3COO]- 228.06999 146.0
[M+Na-2H]- 190.03081 136.1
[M]+ 169.05559 130.0
[M]- 169.05669 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