CID 60890

Drobuline

Structural Information

Molecular Formula
C19H25NO
SMILES
CC(C)NCC(CC(C1=CC=CC=C1)C2=CC=CC=C2)O
InChI
InChI=1S/C19H25NO/c1-15(2)20-14-18(21)13-19(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-12,15,18-21H,13-14H2,1-2H3
InChIKey
DAIZVBCVNQSHLI-UHFFFAOYSA-N
Compound name
4,4-diphenyl-1-(propan-2-ylamino)butan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

174
Patents

283.1936 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.200876 171.2
[M+Na]+ 306.182818 173.3
[M-H]- 282.186324 175.2
[M+NH4]+ 301.227423 185.1
[M+K]+ 322.156758 169.4
[M+H-H2O]+ 266.190860 163.0
[M+HCOO]- 328.191801 190.5
[M+CH3COO]- 342.207451 204.0
[M+Na-2H]- 304.168266 172.7
[M]+ 283.19305142 168.9
[M]- 283.19414858 168.9
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

No patent data available for this compound.