CID 15675902

(1,3-benzoxazol-2-ylmethyl)(methyl)amine

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

17
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 129.9
[M+Na]+ 185.06854 140.0
[M-H]- 161.07204 134.5
[M+NH4]+ 180.11314 151.0
[M+K]+ 201.04248 138.5
[M+H-H2O]+ 145.07658 123.6
[M+HCOO]- 207.07752 155.7
[M+CH3COO]- 221.09317 144.9
[M+Na-2H]- 183.05399 140.3
[M]+ 162.07877 133.1
[M]- 162.07987 133.1
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