CID 41246

54951-31-4

Structural Information

Molecular Formula
C19H30N2O2
SMILES
CC(C)N(CCN1C(=O)CCCC2=C1C=C(C=C2)OC)C(C)C
InChI
InChI=1S/C19H30N2O2/c1-14(2)20(15(3)4)11-12-21-18-13-17(23-5)10-9-16(18)7-6-8-19(21)22/h9-10,13-15H,6-8,11-12H2,1-5H3
InChIKey
WUUPKSODGWXAMQ-UHFFFAOYSA-N
Compound name
1-[2-[di(propan-2-yl)amino]ethyl]-8-methoxy-4,5-dihydro-3H-1-benzazepin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

318.23074 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.23802 174.8
[M+Na]+ 341.21996 183.0
[M+NH4]+ 336.26456 181.0
[M+K]+ 357.19390 178.9
[M-H]- 317.22346 176.4
[M+Na-2H]- 339.20541 177.8
[M]+ 318.23019 176.3
[M]- 318.23129 176.3
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.