CID 16518

2148-77-8

Structural Information

Molecular Formula
C14H18N2O2
SMILES
CN(C)CCC1=CC(=NO1)C2=CC=C(C=C2)OC
InChI
InChI=1S/C14H18N2O2/c1-16(2)9-8-13-10-14(15-18-13)11-4-6-12(17-3)7-5-11/h4-7,10H,8-9H2,1-3H3
InChIKey
UCVKEFXOTIEFHQ-UHFFFAOYSA-N
Compound name
2-[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]-N,N-dimethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

246.13683 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.14411 156.7
[M+Na]+ 269.12605 164.4
[M-H]- 245.12955 164.4
[M+NH4]+ 264.17065 173.7
[M+K]+ 285.09999 163.8
[M+H-H2O]+ 229.13409 148.5
[M+HCOO]- 291.13503 181.6
[M+CH3COO]- 305.15068 199.1
[M+Na-2H]- 267.11150 161.2
[M]+ 246.13628 161.8
[M]- 246.13738 161.8
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