CID 116129

63992-12-1

Structural Information

Molecular Formula
C18H26N2O2
SMILES
CN(C1CCC2=CC=CC=C12)C(=O)CCCN3CCOCC3
InChI
InChI=1S/C18H26N2O2/c1-19(17-9-8-15-5-2-3-6-16(15)17)18(21)7-4-10-20-11-13-22-14-12-20/h2-3,5-6,17H,4,7-14H2,1H3
InChIKey
PZGHLRDLAGFBCU-UHFFFAOYSA-N
Compound name
N-(2,3-dihydro-1H-inden-1-yl)-N-methyl-4-morpholin-4-ylbutanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

302.19943 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.206706 174.3
[M+Na]+ 325.188648 176.5
[M-H]- 301.192154 180.6
[M+NH4]+ 320.233253 189.0
[M+K]+ 341.162588 175.0
[M+H-H2O]+ 285.196690 165.4
[M+HCOO]- 347.197631 190.9
[M+CH3COO]- 361.213281 208.4
[M+Na-2H]- 323.174096 175.0
[M]+ 302.19888142 171.9
[M]- 302.19997858 171.9
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.