CID 427900

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

Structural Information

Molecular Formula
C10H11NO2
SMILES
C1C(C(C2=CC=CC=C21)N)C(=O)O
InChI
InChI=1S/C10H11NO2/c11-9-7-4-2-1-3-6(7)5-8(9)10(12)13/h1-4,8-9H,5,11H2,(H,12,13)
InChIKey
DNDUYUYIRYKACW-UHFFFAOYSA-N
Compound name
1-amino-2,3-dihydro-1H-indene-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

97
Patents

177.07898 Da
Monoisotopic Mass

-1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.08626 136.4
[M+Na]+ 200.06820 146.5
[M+NH4]+ 195.11280 144.8
[M+K]+ 216.04214 143.3
[M-H]- 176.07170 138.0
[M+Na-2H]- 198.05365 140.4
[M]+ 177.07843 137.9
[M]- 177.07953 137.9
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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