CID 212088

23903-11-9

Structural Information

Molecular Formula
C19H25NO
SMILES
CN(CCCO)CCC(C1=CC=CC=C1)C2=CC=CC=C2
InChI
InChI=1S/C19H25NO/c1-20(14-8-16-21)15-13-19(17-9-4-2-5-10-17)18-11-6-3-7-12-18/h2-7,9-12,19,21H,8,13-16H2,1H3
InChIKey
XDMUMVWBXZKTQI-UHFFFAOYSA-N
Compound name
3-[3,3-diphenylpropyl(methyl)amino]propan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

283.1936 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.20088 170.9
[M+Na]+ 306.18282 173.8
[M-H]- 282.18632 176.3
[M+NH4]+ 301.22742 185.7
[M+K]+ 322.15676 170.1
[M+H-H2O]+ 266.19086 162.2
[M+HCOO]- 328.19180 192.8
[M+CH3COO]- 342.20745 205.6
[M+Na-2H]- 304.16827 174.1
[M]+ 283.19305 171.1
[M]- 283.19415 171.1
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