CID 83960273

Spiro[cyclopropane-1,3'-indoline]-5'-carboxylic acid hydrochloride

Structural Information

Molecular Formula
C11H11NO2
SMILES
C1CC12CNC3=C2C=C(C=C3)C(=O)O
InChI
InChI=1S/C11H11NO2/c13-10(14)7-1-2-9-8(5-7)11(3-4-11)6-12-9/h1-2,5,12H,3-4,6H2,(H,13,14)
InChIKey
LFPLUUOCTMWVSA-UHFFFAOYSA-N
Compound name
spiro[1,2-dihydroindole-3,1'-cyclopropane]-5-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

189.07898 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.08626 142.1
[M+Na]+ 212.06820 152.5
[M-H]- 188.07170 145.9
[M+NH4]+ 207.11280 159.3
[M+K]+ 228.04214 147.7
[M+H-H2O]+ 172.07624 137.1
[M+HCOO]- 234.07718 160.3
[M+CH3COO]- 248.09283 154.4
[M+Na-2H]- 210.05365 147.8
[M]+ 189.07843 142.0
[M]- 189.07953 142.0
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.