CID 199511

3-(dimethylamino)-1,1-diphenylpropan-1-ol

Structural Information

Molecular Formula
C17H21NO
SMILES
CN(C)CCC(C1=CC=CC=C1)(C2=CC=CC=C2)O
InChI
InChI=1S/C17H21NO/c1-18(2)14-13-17(19,15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,19H,13-14H2,1-2H3
InChIKey
MUMQBHMGYFNLPO-UHFFFAOYSA-N
Compound name
3-(dimethylamino)-1,1-diphenylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

2
Patents

255.16231 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.16959 161.0
[M+Na]+ 278.15153 165.6
[M-H]- 254.15503 167.1
[M+NH4]+ 273.19613 177.2
[M+K]+ 294.12547 162.4
[M+H-H2O]+ 238.15957 153.3
[M+HCOO]- 300.16051 183.0
[M+CH3COO]- 314.17616 199.2
[M+Na-2H]- 276.13698 167.3
[M]+ 255.16176 160.7
[M]- 255.16286 160.7
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