CID 74837

2016-04-8

Structural Information

Molecular Formula
C17H21NO2
SMILES
CN(C)C(OCC1=CC=CC=C1)OCC2=CC=CC=C2
InChI
InChI=1S/C17H21NO2/c1-18(2)17(19-13-15-9-5-3-6-10-15)20-14-16-11-7-4-8-12-16/h3-12,17H,13-14H2,1-2H3
InChIKey
JFIKHFNGAURIIB-UHFFFAOYSA-N
Compound name
N,N-dimethyl-1,1-bis(phenylmethoxy)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

170
Patents

271.15723 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.164506 165.0
[M+Na]+ 294.146448 169.0
[M-H]- 270.149954 172.1
[M+NH4]+ 289.191053 180.9
[M+K]+ 310.120388 167.4
[M+H-H2O]+ 254.154490 156.1
[M+HCOO]- 316.155431 189.2
[M+CH3COO]- 330.171081 204.2
[M+Na-2H]- 292.131896 169.7
[M]+ 271.15668142 167.8
[M]- 271.15777858 167.8
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