CID 251744

(benzyloxy)(ethyl)amine

Structural Information

Molecular Formula
C9H13NO
SMILES
CCNOCC1=CC=CC=C1
InChI
InChI=1S/C9H13NO/c1-2-10-11-8-9-6-4-3-5-7-9/h3-7,10H,2,8H2,1H3
InChIKey
YUESULCDVWCTSX-UHFFFAOYSA-N
Compound name
N-phenylmethoxyethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

82
Patents

151.09972 Da
Monoisotopic Mass

1.7
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