CID 3048942

1-acetyl-1'-allylspiro(indoline-3,3'-pyrrolidine) oxalate

Structural Information

Molecular Formula
C16H20N2O
SMILES
CC(=O)N1CC2(CCN(C2)CC=C)C3=CC=CC=C31
InChI
InChI=1S/C16H20N2O/c1-3-9-17-10-8-16(11-17)12-18(13(2)19)15-7-5-4-6-14(15)16/h3-7H,1,8-12H2,2H3
InChIKey
QYDWLWYYFOIVMU-UHFFFAOYSA-N
Compound name
1-(1'-prop-2-enylspiro[2H-indole-3,3'-pyrrolidine]-1-yl)ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

256.15756 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.16484 162.8
[M+Na]+ 279.14678 173.2
[M+NH4]+ 274.19138 172.3
[M+K]+ 295.12072 168.0
[M-H]- 255.15028 164.2
[M+Na-2H]- 277.13223 167.3
[M]+ 256.15701 164.6
[M]- 256.15811 164.6
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.