CID 215268

2-(alpha-ethyl-2-thenylamino)-2-oxazoline

Structural Information

Molecular Formula
C10H14N2OS
SMILES
CCC(C1=CC=CS1)NC2=NCCO2
InChI
InChI=1S/C10H14N2OS/c1-2-8(9-4-3-7-14-9)12-10-11-5-6-13-10/h3-4,7-8H,2,5-6H2,1H3,(H,11,12)
InChIKey
ANMFSKZAOMFWOH-UHFFFAOYSA-N
Compound name
N-(1-thiophen-2-ylpropyl)-4,5-dihydro-1,3-oxazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

210.08269 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.08997 146.5
[M+Na]+ 233.07191 153.5
[M-H]- 209.07541 152.9
[M+NH4]+ 228.11651 166.5
[M+K]+ 249.04585 152.7
[M+H-H2O]+ 193.07995 140.1
[M+HCOO]- 255.08089 165.5
[M+CH3COO]- 269.09654 159.5
[M+Na-2H]- 231.05736 147.5
[M]+ 210.08214 148.0
[M]- 210.08324 148.0
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