CID 37732

N-methyl-2-phenoxyethanamine

Structural Information

Molecular Formula
C9H13NO
SMILES
CNCCOC1=CC=CC=C1
InChI
InChI=1S/C9H13NO/c1-10-7-8-11-9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3
InChIKey
GUMBNOITRNRLCS-UHFFFAOYSA-N
Compound name
N-methyl-2-phenoxyethanamine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

3
References

278
Patents

151.09972 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.10700 131.7
[M+Na]+ 174.08894 143.9
[M+NH4]+ 169.13354 140.9
[M+K]+ 190.06288 136.7
[M-H]- 150.09244 134.9
[M+Na-2H]- 172.07439 139.7
[M]+ 151.09917 134.3
[M]- 151.10027 134.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe