CID 37727

37391-17-6

Structural Information

Molecular Formula
C20H24N2O
SMILES
CC1(C2=CC=CC=C2N(C1=O)CCCN(C)C)C3=CC=CC=C3
InChI
InChI=1S/C20H24N2O/c1-20(16-10-5-4-6-11-16)17-12-7-8-13-18(17)22(19(20)23)15-9-14-21(2)3/h4-8,10-13H,9,14-15H2,1-3H3
InChIKey
VOEPCQNXNIAYJR-UHFFFAOYSA-N
Compound name
1-[3-(dimethylamino)propyl]-3-methyl-3-phenylindol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

308.18887 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.196146 175.2
[M+Na]+ 331.178088 182.7
[M-H]- 307.181594 182.7
[M+NH4]+ 326.222693 194.0
[M+K]+ 347.152028 178.3
[M+H-H2O]+ 291.186130 166.6
[M+HCOO]- 353.187071 197.3
[M+CH3COO]- 367.202721 212.8
[M+Na-2H]- 329.163536 178.0
[M]+ 308.18832142 177.6
[M]- 308.18941858 177.6
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.