CID 13761774

15448-77-8

Structural Information

Molecular Formula

C₁₀H₁₄O₄

SMILES

COC(=O)C12CCC(C1)(CC2)C(=O)O

InChI

InChI=1S/C10H14O4/c1-14-8(13)10-4-2-9(6-10,3-5-10)7(11)12/h2-6H2,1H3,(H,11,12)

InChIKey

KVIKABYOBCHKNX-UHFFFAOYSA-N

Compound name

4-methoxycarbonylbicyclo[2.2.1]heptane-1-carboxylic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 272
Patents: 198.0892 Da
Monoisotopic Mass: 0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	199.09648	145.2
[M+Na]+	221.07842	151.0
[M+NH4]+	216.12302	155.1
[M+K]+	237.05236	147.6
[M-H]-	197.08192	142.8
[M+Na-2H]-	219.06387	147.3
[M]+	198.08865	145.1
[M]-	198.08975	145.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe