CID 3051472

67465-84-3

Structural Information

Molecular Formula
C17H21NO
SMILES
CC(CN(CC1=CC=CC=C1)CC2=CC=CC=C2)O
InChI
InChI=1S/C17H21NO/c1-15(19)12-18(13-16-8-4-2-5-9-16)14-17-10-6-3-7-11-17/h2-11,15,19H,12-14H2,1H3
InChIKey
WXEYIBICXWVANI-UHFFFAOYSA-N
Compound name
1-(dibenzylamino)propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

73
Patents

255.16231 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.16959 161.7
[M+Na]+ 278.15153 165.5
[M-H]- 254.15503 167.4
[M+NH4]+ 273.19613 177.6
[M+K]+ 294.12547 162.3
[M+H-H2O]+ 238.15957 153.4
[M+HCOO]- 300.16051 184.3
[M+CH3COO]- 314.17616 199.6
[M+Na-2H]- 276.13698 166.0
[M]+ 255.16176 161.2
[M]- 255.16286 161.2
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