CID 61746

Alpha-terpinyl anthranilate

Structural Information

Molecular Formula
C17H23NO2
SMILES
CC1=CCC(CC1)C(C)(C)OC(=O)C2=CC=CC=C2N
InChI
InChI=1S/C17H23NO2/c1-12-8-10-13(11-9-12)17(2,3)20-16(19)14-6-4-5-7-15(14)18/h4-8,13H,9-11,18H2,1-3H3
InChIKey
UHUIKPAIJHOKNF-UHFFFAOYSA-N
Compound name
2-(4-methylcyclohex-3-en-1-yl)propan-2-yl 2-aminobenzoate
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

0
References

119
Patents

273.17288 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.18016 166.2
[M+Na]+ 296.16210 177.3
[M+NH4]+ 291.20670 173.8
[M+K]+ 312.13604 171.3
[M-H]- 272.16560 169.9
[M+Na-2H]- 294.14755 172.7
[M]+ 273.17233 168.8
[M]- 273.17343 168.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe