CID 10954341

1-methyl-1,2,3,4-tetrahydronaphthalene-1-carboxylic acid

Structural Information

Molecular Formula
C12H14O2
SMILES
CC1(CCCC2=CC=CC=C21)C(=O)O
InChI
InChI=1S/C12H14O2/c1-12(11(13)14)8-4-6-9-5-2-3-7-10(9)12/h2-3,5,7H,4,6,8H2,1H3,(H,13,14)
InChIKey
GKAFAFBEKXKBLN-UHFFFAOYSA-N
Compound name
1-methyl-3,4-dihydro-2H-naphthalene-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

190.09938 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.10666 141.6
[M+Na]+ 213.08860 153.9
[M+NH4]+ 208.13320 152.3
[M+K]+ 229.06254 145.5
[M-H]- 189.09210 143.9
[M+Na-2H]- 211.07405 148.8
[M]+ 190.09883 144.1
[M]- 190.09993 144.1
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