CID 12701643

13861-75-1

Structural Information

Molecular Formula
C10H9NO
SMILES
C1CC12C3=CC=CC=C3NC2=O
InChI
InChI=1S/C10H9NO/c12-9-10(5-6-10)7-3-1-2-4-8(7)11-9/h1-4H,5-6H2,(H,11,12)
InChIKey
LBBWIBWOPGDMAJ-UHFFFAOYSA-N
Compound name
spiro[1H-indole-3,1'-cyclopropane]-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

235
Patents

159.06842 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.07570 136.9
[M+Na]+ 182.05764 150.9
[M+NH4]+ 177.10224 148.4
[M+K]+ 198.03158 145.2
[M-H]- 158.06114 146.3
[M+Na-2H]- 180.04309 146.5
[M]+ 159.06787 142.8
[M]- 159.06897 142.8
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

patents stripe