CID 3063663

Morpholine, 4-(o-(2-(dimethylamino)ethoxy)thiobenzoyl)-

Structural Information

Molecular Formula
C15H22N2O2S
SMILES
CN(C)CCOC1=CC=CC=C1C(=S)N2CCOCC2
InChI
InChI=1S/C15H22N2O2S/c1-16(2)7-12-19-14-6-4-3-5-13(14)15(20)17-8-10-18-11-9-17/h3-6H,7-12H2,1-2H3
InChIKey
VOQURIPSMRIIEN-UHFFFAOYSA-N
Compound name
[2-[2-(dimethylamino)ethoxy]phenyl]-morpholin-4-ylmethanethione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

294.1402 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.14748 169.2
[M+Na]+ 317.12942 172.8
[M-H]- 293.13292 175.3
[M+NH4]+ 312.17402 182.4
[M+K]+ 333.10336 171.5
[M+H-H2O]+ 277.13746 160.4
[M+HCOO]- 339.13840 182.9
[M+CH3COO]- 353.15405 205.2
[M+Na-2H]- 315.11487 169.8
[M]+ 294.13965 170.0
[M]- 294.14075 170.0
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.