CID 3048856

64053-78-7

Structural Information

Molecular Formula
C10H9NO
SMILES
C1CC12C(=O)C3=CC=CC=C3N2
InChI
InChI=1S/C10H9NO/c12-9-7-3-1-2-4-8(7)11-10(9)5-6-10/h1-4,11H,5-6H2
InChIKey
JFGZKZGGDVMKDC-UHFFFAOYSA-N
Compound name
spiro[1H-indole-2,1'-cyclopropane]-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

159.06842 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.075696 135.6
[M+Na]+ 182.057638 147.2
[M-H]- 158.061144 140.8
[M+NH4]+ 177.102243 154.7
[M+K]+ 198.031578 142.8
[M+H-H2O]+ 142.065680 130.1
[M+HCOO]- 204.066621 156.4
[M+CH3COO]- 218.082271 149.2
[M+Na-2H]- 180.043086 143.1
[M]+ 159.06787142 135.9
[M]- 159.06896858 135.9
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

patents stripe