CID 249470

501418-06-0

Structural Information

Molecular Formula
C11H10O2
SMILES
C1C2C(C2C(=O)O)C3=CC=CC=C31
InChI
InChI=1S/C11H10O2/c12-11(13)10-8-5-6-3-1-2-4-7(6)9(8)10/h1-4,8-10H,5H2,(H,12,13)
InChIKey
PPNDVQGPAPLJNH-UHFFFAOYSA-N
Compound name
1,1a,6,6a-tetrahydrocyclopropa[a]indene-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

174.06808 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.075356 134.1
[M+Na]+ 197.057298 145.4
[M-H]- 173.060804 139.5
[M+NH4]+ 192.101903 153.0
[M+K]+ 213.031238 140.7
[M+H-H2O]+ 157.065340 129.6
[M+HCOO]- 219.066281 155.0
[M+CH3COO]- 233.081931 148.0
[M+Na-2H]- 195.042746 140.0
[M]+ 174.06753142 137.1
[M]- 174.06862858 137.1
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