CID 3042075

2-indoline-3-spiro-3'-(n-propylpyrrolidine) hydrochloride

Structural Information

Molecular Formula
C14H18N2O
SMILES
CCCN1CCC2(C1)C3=CC=CC=C3NC2=O
InChI
InChI=1S/C14H18N2O/c1-2-8-16-9-7-14(10-16)11-5-3-4-6-12(11)15-13(14)17/h3-6H,2,7-10H2,1H3,(H,15,17)
InChIKey
YOJNAPRBCHKGBD-UHFFFAOYSA-N
Compound name
1'-propylspiro[1H-indole-3,3'-pyrrolidine]-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

230.1419 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.149176 155.0
[M+Na]+ 253.131118 163.2
[M-H]- 229.134624 157.7
[M+NH4]+ 248.175723 176.7
[M+K]+ 269.105058 158.3
[M+H-H2O]+ 213.139160 148.1
[M+HCOO]- 275.140101 172.8
[M+CH3COO]- 289.155751 166.7
[M+Na-2H]- 251.116566 157.1
[M]+ 230.14135142 151.9
[M]- 230.14244858 151.9
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

No patent data available for this compound.