CID 15675902

136727-12-3

Structural Information

Molecular Formula
C9H10N2O
SMILES
CNCC1=NC2=CC=CC=C2O1
InChI
InChI=1S/C9H10N2O/c1-10-6-9-11-7-4-2-3-5-8(7)12-9/h2-5,10H,6H2,1H3
InChIKey
NFGYJXAQDDQWIQ-UHFFFAOYSA-N
Compound name
1-(1,3-benzoxazol-2-yl)-N-methylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

162.07932 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.08660 130.6
[M+Na]+ 185.06854 144.4
[M+NH4]+ 180.11314 140.0
[M+K]+ 201.04248 139.5
[M-H]- 161.07204 134.7
[M+Na-2H]- 183.05399 138.0
[M]+ 162.07877 133.8
[M]- 162.07987 133.8
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