CID 3046785

Brn 2306744

Structural Information

Molecular Formula
C20H23FN2O2
SMILES
CC(C)NC(=O)CCCN=C(C1=CC=CC=C1)C2=C(C=CC(=C2)F)O
InChI
InChI=1S/C20H23FN2O2/c1-14(2)23-19(25)9-6-12-22-20(15-7-4-3-5-8-15)17-13-16(21)10-11-18(17)24/h3-5,7-8,10-11,13-14,24H,6,9,12H2,1-2H3,(H,23,25)
InChIKey
CGQPQAPIABDIEX-UHFFFAOYSA-N
Compound name
4-[[(5-fluoro-2-hydroxyphenyl)-phenylmethylidene]amino]-N-propan-2-ylbutanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

342.17435 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.18163 183.6
[M+Na]+ 365.16357 187.4
[M-H]- 341.16707 188.2
[M+NH4]+ 360.20817 195.9
[M+K]+ 381.13751 183.2
[M+H-H2O]+ 325.17161 173.7
[M+HCOO]- 387.17255 204.6
[M+CH3COO]- 401.18820 218.7
[M+Na-2H]- 363.14902 183.4
[M]+ 342.17380 182.4
[M]- 342.17490 182.4
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

No patent data available for this compound.