CID 232840

2,3-dihydro-1h-indene-4-carboxylic acid

Structural Information

Molecular Formula
C10H10O2
SMILES
C1CC2=C(C1)C(=CC=C2)C(=O)O
InChI
InChI=1S/C10H10O2/c11-10(12)9-6-2-4-7-3-1-5-8(7)9/h2,4,6H,1,3,5H2,(H,11,12)
InChIKey
QJQQSHWSGOMJDZ-UHFFFAOYSA-N
Compound name
2,3-dihydro-1H-indene-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

89
Patents

162.06808 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.07536 132.8
[M+Na]+ 185.05730 144.2
[M+NH4]+ 180.10190 142.0
[M+K]+ 201.03124 140.1
[M-H]- 161.06080 134.3
[M+Na-2H]- 183.04275 137.8
[M]+ 162.06753 134.7
[M]- 162.06863 134.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

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Patent stripe

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