CID 21149849

(s)-n-[3-methyl-1-[(2-naphthylamino)carbonyl]butyl]benzamide

Structural Information

Molecular Formula
C23H24N2O2
SMILES
CC(C)C[C@@H](C(=O)NC1=CC2=CC=CC=C2C=C1)NC(=O)C3=CC=CC=C3
InChI
InChI=1S/C23H24N2O2/c1-16(2)14-21(25-22(26)18-9-4-3-5-10-18)23(27)24-20-13-12-17-8-6-7-11-19(17)15-20/h3-13,15-16,21H,14H2,1-2H3,(H,24,27)(H,25,26)/t21-/m0/s1
InChIKey
QTJKADZPYFJSEQ-NRFANRHFSA-N
Compound name
N-[(2S)-4-methyl-1-(naphthalen-2-ylamino)-1-oxopentan-2-yl]benzamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

360.18378 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 361.191056 188.2
[M+Na]+ 383.172998 190.5
[M-H]- 359.176504 194.4
[M+NH4]+ 378.217603 200.1
[M+K]+ 399.146938 186.3
[M+H-H2O]+ 343.181040 178.9
[M+HCOO]- 405.181981 207.9
[M+CH3COO]- 419.197631 222.4
[M+Na-2H]- 381.158446 190.1
[M]+ 360.18323142 186.8
[M]- 360.18432858 186.8
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

No patent data available for this compound.